USER MOD reduce.3.24.130724 H: found=0, std=0, add=994, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 988 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= -0.577 K(o=-0.58,f=-1.5) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -114:sc=-0.00394 (180deg=-1.02) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.0953 X(o=-0.095,f=-0.13) USER MOD Single : A 67 HIS : no HD1:sc= -0.0159 X(o=-0.016,f=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ -141:sc= 0.362 (180deg=-0.0539) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 77:sc= 1.08 USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= -0.163 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= -0.081 X(o=-0.081,f=-0.41) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 GLN : amide:sc= -1.65 X(o=-1.7,f=-1.6) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot -110:sc= 0.685 USER MOD Single : A 115 SER OG : rot 32:sc= -0.497 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -52:sc= 0.91 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 81.081 -58.320 22.208 1.00 0.00 N ATOM 2 CA GLY A 1 80.662 -57.080 22.832 1.00 0.00 C ATOM 3 C GLY A 1 81.393 -55.874 22.276 1.00 0.00 C ATOM 4 O GLY A 1 82.214 -55.266 22.963 1.00 0.00 O ATOM 0 H1 GLY A 1 80.552 -59.113 22.623 1.00 0.00 H new ATOM 0 H2 GLY A 1 80.893 -58.275 21.186 1.00 0.00 H new ATOM 0 H3 GLY A 1 82.099 -58.462 22.367 1.00 0.00 H new ATOM 0 HA2 GLY A 1 79.590 -56.949 22.688 1.00 0.00 H new ATOM 0 HA3 GLY A 1 80.834 -57.142 23.907 1.00 0.00 H new ATOM 8 N SER A 2 81.097 -55.528 21.027 1.00 0.00 N ATOM 9 CA SER A 2 81.736 -54.391 20.376 1.00 0.00 C ATOM 10 C SER A 2 80.887 -53.880 19.217 1.00 0.00 C ATOM 11 O SER A 2 81.216 -54.064 18.044 1.00 0.00 O ATOM 12 CB SER A 2 83.127 -54.781 19.872 1.00 0.00 C ATOM 13 OG SER A 2 83.898 -53.632 19.565 1.00 0.00 O ATOM 0 H SER A 2 80.418 -56.019 20.446 1.00 0.00 H new ATOM 0 HA SER A 2 81.834 -53.592 21.110 1.00 0.00 H new ATOM 0 HB2 SER A 2 83.639 -55.375 20.630 1.00 0.00 H new ATOM 0 HB3 SER A 2 83.034 -55.408 18.985 1.00 0.00 H new ATOM 0 HG SER A 2 84.783 -53.907 19.247 1.00 0.00 H new ATOM 19 N PRO A 3 79.766 -53.223 19.550 1.00 0.00 N ATOM 20 CA PRO A 3 78.845 -52.672 18.551 1.00 0.00 C ATOM 21 C PRO A 3 79.440 -51.480 17.810 1.00 0.00 C ATOM 22 O PRO A 3 79.405 -50.351 18.299 1.00 0.00 O ATOM 23 CB PRO A 3 77.638 -52.234 19.385 1.00 0.00 C ATOM 24 CG PRO A 3 78.189 -51.983 20.746 1.00 0.00 C ATOM 25 CD PRO A 3 79.311 -52.968 20.927 1.00 0.00 C ATOM 0 HA PRO A 3 78.604 -53.398 17.775 1.00 0.00 H new ATOM 0 HB2 PRO A 3 77.177 -51.336 18.973 1.00 0.00 H new ATOM 0 HB3 PRO A 3 76.869 -53.007 19.405 1.00 0.00 H new ATOM 0 HG2 PRO A 3 78.550 -50.959 20.838 1.00 0.00 H new ATOM 0 HG3 PRO A 3 77.422 -52.120 21.509 1.00 0.00 H new ATOM 0 HD2 PRO A 3 80.110 -52.558 21.545 1.00 0.00 H new ATOM 0 HD3 PRO A 3 78.969 -53.882 21.413 1.00 0.00 H new ATOM 33 N PHE A 4 79.987 -51.738 16.626 1.00 0.00 N ATOM 34 CA PHE A 4 80.591 -50.686 15.817 1.00 0.00 C ATOM 35 C PHE A 4 79.531 -49.951 15.001 1.00 0.00 C ATOM 36 O PHE A 4 79.599 -49.904 13.774 1.00 0.00 O ATOM 37 CB PHE A 4 81.651 -51.275 14.884 1.00 0.00 C ATOM 38 CG PHE A 4 82.559 -50.242 14.281 1.00 0.00 C ATOM 39 CD1 PHE A 4 83.374 -49.462 15.085 1.00 0.00 C ATOM 40 CD2 PHE A 4 82.600 -50.053 12.909 1.00 0.00 C ATOM 41 CE1 PHE A 4 84.210 -48.510 14.533 1.00 0.00 C ATOM 42 CE2 PHE A 4 83.434 -49.103 12.350 1.00 0.00 C ATOM 43 CZ PHE A 4 84.241 -48.332 13.163 1.00 0.00 C ATOM 0 H PHE A 4 80.024 -52.667 16.206 1.00 0.00 H new ATOM 0 HA PHE A 4 81.066 -49.972 16.490 1.00 0.00 H new ATOM 0 HB2 PHE A 4 82.252 -51.996 15.439 1.00 0.00 H new ATOM 0 HB3 PHE A 4 81.155 -51.823 14.083 1.00 0.00 H new ATOM 0 HD1 PHE A 4 83.356 -49.600 16.156 1.00 0.00 H new ATOM 0 HD2 PHE A 4 81.973 -50.655 12.269 1.00 0.00 H new ATOM 0 HE1 PHE A 4 84.838 -47.906 15.171 1.00 0.00 H new ATOM 0 HE2 PHE A 4 83.454 -48.964 11.279 1.00 0.00 H new ATOM 0 HZ PHE A 4 84.896 -47.591 12.729 1.00 0.00 H new ATOM 53 N ALA A 5 78.552 -49.378 15.694 1.00 0.00 N ATOM 54 CA ALA A 5 77.478 -48.645 15.035 1.00 0.00 C ATOM 55 C ALA A 5 77.636 -47.142 15.237 1.00 0.00 C ATOM 56 O ALA A 5 77.877 -46.677 16.351 1.00 0.00 O ATOM 57 CB ALA A 5 76.126 -49.109 15.554 1.00 0.00 C ATOM 0 H ALA A 5 78.481 -49.407 16.711 1.00 0.00 H new ATOM 0 HA ALA A 5 77.534 -48.850 13.966 1.00 0.00 H new ATOM 0 HB1 ALA A 5 75.334 -48.553 15.053 1.00 0.00 H new ATOM 0 HB2 ALA A 5 76.005 -50.174 15.353 1.00 0.00 H new ATOM 0 HB3 ALA A 5 76.069 -48.934 16.628 1.00 0.00 H new ATOM 63 N ASP A 6 77.501 -46.387 14.152 1.00 0.00 N ATOM 64 CA ASP A 6 77.629 -44.935 14.210 1.00 0.00 C ATOM 65 C ASP A 6 76.286 -44.260 13.946 1.00 0.00 C ATOM 66 O ASP A 6 75.390 -44.829 13.323 1.00 0.00 O ATOM 67 CB ASP A 6 78.665 -44.452 13.194 1.00 0.00 C ATOM 68 CG ASP A 6 79.728 -45.495 12.910 1.00 0.00 C ATOM 69 OD1 ASP A 6 80.455 -45.872 13.852 1.00 0.00 O ATOM 70 OD2 ASP A 6 79.833 -45.935 11.745 1.00 0.00 O ATOM 0 H ASP A 6 77.303 -46.756 13.222 1.00 0.00 H new ATOM 0 HA ASP A 6 77.961 -44.664 15.212 1.00 0.00 H new ATOM 0 HB2 ASP A 6 78.162 -44.188 12.264 1.00 0.00 H new ATOM 0 HB3 ASP A 6 79.141 -43.545 13.568 1.00 0.00 H new ATOM 75 N PRO A 7 76.143 -43.018 14.431 1.00 0.00 N ATOM 76 CA PRO A 7 74.913 -42.239 14.261 1.00 0.00 C ATOM 77 C PRO A 7 74.698 -41.805 12.815 1.00 0.00 C ATOM 78 O PRO A 7 75.206 -40.770 12.385 1.00 0.00 O ATOM 79 CB PRO A 7 75.138 -41.019 15.157 1.00 0.00 C ATOM 80 CG PRO A 7 76.619 -40.880 15.243 1.00 0.00 C ATOM 81 CD PRO A 7 77.170 -42.278 15.183 1.00 0.00 C ATOM 0 HA PRO A 7 74.026 -42.817 14.520 1.00 0.00 H new ATOM 0 HB2 PRO A 7 74.681 -40.126 14.732 1.00 0.00 H new ATOM 0 HB3 PRO A 7 74.696 -41.165 16.143 1.00 0.00 H new ATOM 0 HG2 PRO A 7 77.002 -40.274 14.422 1.00 0.00 H new ATOM 0 HG3 PRO A 7 76.911 -40.385 16.169 1.00 0.00 H new ATOM 0 HD2 PRO A 7 78.136 -42.308 14.679 1.00 0.00 H new ATOM 0 HD3 PRO A 7 77.317 -42.695 16.179 1.00 0.00 H new ATOM 89 N ASN A 8 73.940 -42.602 12.069 1.00 0.00 N ATOM 90 CA ASN A 8 73.657 -42.299 10.670 1.00 0.00 C ATOM 91 C ASN A 8 72.610 -41.196 10.554 1.00 0.00 C ATOM 92 O ASN A 8 71.417 -41.436 10.741 1.00 0.00 O ATOM 93 CB ASN A 8 73.174 -43.555 9.942 1.00 0.00 C ATOM 94 CG ASN A 8 72.904 -43.303 8.472 1.00 0.00 C ATOM 95 OD1 ASN A 8 73.830 -43.138 7.678 1.00 0.00 O ATOM 96 ND2 ASN A 8 71.629 -43.272 8.102 1.00 0.00 N ATOM 0 H ASN A 8 73.511 -43.462 12.409 1.00 0.00 H new ATOM 0 HA ASN A 8 74.579 -41.950 10.206 1.00 0.00 H new ATOM 0 HB2 ASN A 8 73.923 -44.340 10.042 1.00 0.00 H new ATOM 0 HB3 ASN A 8 72.264 -43.920 10.418 1.00 0.00 H new ATOM 0 HD21 ASN A 8 71.385 -43.106 7.126 1.00 0.00 H new ATOM 0 HD22 ASN A 8 70.893 -43.414 8.794 1.00 0.00 H new ATOM 103 N SER A 9 73.065 -39.986 10.242 1.00 0.00 N ATOM 104 CA SER A 9 72.168 -38.845 10.103 1.00 0.00 C ATOM 105 C SER A 9 72.902 -37.647 9.508 1.00 0.00 C ATOM 106 O SER A 9 73.932 -37.214 10.027 1.00 0.00 O ATOM 107 CB SER A 9 71.573 -38.469 11.461 1.00 0.00 C ATOM 108 OG SER A 9 70.579 -37.468 11.323 1.00 0.00 O ATOM 0 H SER A 9 74.049 -39.771 10.081 1.00 0.00 H new ATOM 0 HA SER A 9 71.362 -39.128 9.427 1.00 0.00 H new ATOM 0 HB2 SER A 9 71.141 -39.353 11.929 1.00 0.00 H new ATOM 0 HB3 SER A 9 72.363 -38.113 12.122 1.00 0.00 H new ATOM 0 HG SER A 9 70.213 -37.247 12.205 1.00 0.00 H new ATOM 114 N LEU A 10 72.364 -37.116 8.415 1.00 0.00 N ATOM 115 CA LEU A 10 72.967 -35.967 7.747 1.00 0.00 C ATOM 116 C LEU A 10 71.895 -34.998 7.259 1.00 0.00 C ATOM 117 O LEU A 10 71.172 -35.285 6.305 1.00 0.00 O ATOM 118 CB LEU A 10 73.827 -36.430 6.570 1.00 0.00 C ATOM 119 CG LEU A 10 74.763 -35.381 5.969 1.00 0.00 C ATOM 120 CD1 LEU A 10 76.003 -36.042 5.388 1.00 0.00 C ATOM 121 CD2 LEU A 10 74.040 -34.568 4.905 1.00 0.00 C ATOM 0 H LEU A 10 71.512 -37.462 7.973 1.00 0.00 H new ATOM 0 HA LEU A 10 73.599 -35.448 8.468 1.00 0.00 H new ATOM 0 HB2 LEU A 10 74.427 -37.279 6.897 1.00 0.00 H new ATOM 0 HB3 LEU A 10 73.166 -36.791 5.783 1.00 0.00 H new ATOM 0 HG LEU A 10 75.077 -34.704 6.763 1.00 0.00 H new ATOM 0 HD11 LEU A 10 76.657 -35.280 4.965 1.00 0.00 H new ATOM 0 HD12 LEU A 10 76.532 -36.578 6.176 1.00 0.00 H new ATOM 0 HD13 LEU A 10 75.709 -36.743 4.606 1.00 0.00 H new ATOM 0 HD21 LEU A 10 74.721 -33.826 4.488 1.00 0.00 H new ATOM 0 HD22 LEU A 10 73.696 -35.231 4.111 1.00 0.00 H new ATOM 0 HD23 LEU A 10 73.184 -34.063 5.352 1.00 0.00 H new ATOM 133 N ALA A 11 71.800 -33.847 7.918 1.00 0.00 N ATOM 134 CA ALA A 11 70.820 -32.834 7.548 1.00 0.00 C ATOM 135 C ALA A 11 71.504 -31.560 7.062 1.00 0.00 C ATOM 136 O ALA A 11 71.959 -30.743 7.864 1.00 0.00 O ATOM 137 CB ALA A 11 69.907 -32.528 8.726 1.00 0.00 C ATOM 0 H ALA A 11 72.390 -33.594 8.711 1.00 0.00 H new ATOM 0 HA ALA A 11 70.219 -33.228 6.729 1.00 0.00 H new ATOM 0 HB1 ALA A 11 69.180 -31.770 8.435 1.00 0.00 H new ATOM 0 HB2 ALA A 11 69.384 -33.436 9.026 1.00 0.00 H new ATOM 0 HB3 ALA A 11 70.502 -32.159 9.561 1.00 0.00 H new ATOM 143 N LEU A 12 71.575 -31.398 5.746 1.00 0.00 N ATOM 144 CA LEU A 12 72.205 -30.224 5.152 1.00 0.00 C ATOM 145 C LEU A 12 71.290 -29.581 4.114 1.00 0.00 C ATOM 146 O LEU A 12 71.396 -29.863 2.921 1.00 0.00 O ATOM 147 CB LEU A 12 73.538 -30.606 4.507 1.00 0.00 C ATOM 148 CG LEU A 12 74.767 -30.536 5.414 1.00 0.00 C ATOM 149 CD1 LEU A 12 75.913 -31.343 4.823 1.00 0.00 C ATOM 150 CD2 LEU A 12 75.188 -29.090 5.631 1.00 0.00 C ATOM 0 H LEU A 12 71.204 -32.065 5.069 1.00 0.00 H new ATOM 0 HA LEU A 12 72.388 -29.500 5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 12 73.454 -31.622 4.121 1.00 0.00 H new ATOM 0 HB3 LEU A 12 73.705 -29.952 3.651 1.00 0.00 H new ATOM 0 HG LEU A 12 74.506 -30.967 6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 12 76.779 -31.282 5.482 1.00 0.00 H new ATOM 0 HD12 LEU A 12 75.609 -32.385 4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 12 76.173 -30.942 3.843 1.00 0.00 H new ATOM 0 HD21 LEU A 12 76.064 -29.059 6.279 1.00 0.00 H new ATOM 0 HD22 LEU A 12 75.430 -28.634 4.671 1.00 0.00 H new ATOM 0 HD23 LEU A 12 74.372 -28.540 6.099 1.00 0.00 H new ATOM 162 N ALA A 13 70.395 -28.715 4.577 1.00 0.00 N ATOM 163 CA ALA A 13 69.465 -28.030 3.689 1.00 0.00 C ATOM 164 C ALA A 13 69.464 -26.527 3.948 1.00 0.00 C ATOM 165 O ALA A 13 68.900 -26.059 4.937 1.00 0.00 O ATOM 166 CB ALA A 13 68.062 -28.597 3.854 1.00 0.00 C ATOM 0 H ALA A 13 70.295 -28.471 5.562 1.00 0.00 H new ATOM 0 HA ALA A 13 69.793 -28.195 2.663 1.00 0.00 H new ATOM 0 HB1 ALA A 13 67.378 -28.076 3.184 1.00 0.00 H new ATOM 0 HB2 ALA A 13 68.068 -29.660 3.611 1.00 0.00 H new ATOM 0 HB3 ALA A 13 67.734 -28.462 4.885 1.00 0.00 H new ATOM 172 N ASN A 14 70.100 -25.777 3.055 1.00 0.00 N ATOM 173 CA ASN A 14 70.173 -24.326 3.188 1.00 0.00 C ATOM 174 C ASN A 14 69.180 -23.643 2.253 1.00 0.00 C ATOM 175 O ASN A 14 69.004 -24.056 1.107 1.00 0.00 O ATOM 176 CB ASN A 14 71.591 -23.837 2.890 1.00 0.00 C ATOM 177 CG ASN A 14 72.517 -23.986 4.081 1.00 0.00 C ATOM 178 OD1 ASN A 14 72.589 -25.050 4.696 1.00 0.00 O ATOM 179 ND2 ASN A 14 73.232 -22.917 4.413 1.00 0.00 N ATOM 0 H ASN A 14 70.572 -26.149 2.231 1.00 0.00 H new ATOM 0 HA ASN A 14 69.915 -24.067 4.215 1.00 0.00 H new ATOM 0 HB2 ASN A 14 71.996 -24.397 2.047 1.00 0.00 H new ATOM 0 HB3 ASN A 14 71.555 -22.790 2.590 1.00 0.00 H new ATOM 0 HD21 ASN A 14 73.872 -22.958 5.206 1.00 0.00 H new ATOM 0 HD22 ASN A 14 73.141 -22.055 3.875 1.00 0.00 H new ATOM 186 N VAL A 15 68.532 -22.594 2.751 1.00 0.00 N ATOM 187 CA VAL A 15 67.558 -21.852 1.960 1.00 0.00 C ATOM 188 C VAL A 15 68.057 -20.444 1.652 1.00 0.00 C ATOM 189 O VAL A 15 68.878 -19.878 2.374 1.00 0.00 O ATOM 190 CB VAL A 15 66.202 -21.756 2.685 1.00 0.00 C ATOM 191 CG1 VAL A 15 65.469 -23.087 2.623 1.00 0.00 C ATOM 192 CG2 VAL A 15 66.400 -21.314 4.127 1.00 0.00 C ATOM 0 H VAL A 15 68.664 -22.239 3.698 1.00 0.00 H new ATOM 0 HA VAL A 15 67.426 -22.400 1.027 1.00 0.00 H new ATOM 0 HB VAL A 15 65.591 -21.008 2.180 1.00 0.00 H new ATOM 0 HG11 VAL A 15 64.513 -23.001 3.140 1.00 0.00 H new ATOM 0 HG12 VAL A 15 65.295 -23.358 1.582 1.00 0.00 H new ATOM 0 HG13 VAL A 15 66.073 -23.857 3.103 1.00 0.00 H new ATOM 0 HG21 VAL A 15 65.432 -21.251 4.624 1.00 0.00 H new ATOM 0 HG22 VAL A 15 67.029 -22.037 4.646 1.00 0.00 H new ATOM 0 HG23 VAL A 15 66.881 -20.336 4.145 1.00 0.00 H new ATOM 202 N PRO A 16 67.551 -19.864 0.554 1.00 0.00 N ATOM 203 CA PRO A 16 67.930 -18.514 0.126 1.00 0.00 C ATOM 204 C PRO A 16 67.395 -17.437 1.062 1.00 0.00 C ATOM 205 O PRO A 16 66.422 -17.655 1.785 1.00 0.00 O ATOM 206 CB PRO A 16 67.288 -18.388 -1.258 1.00 0.00 C ATOM 207 CG PRO A 16 66.140 -19.336 -1.231 1.00 0.00 C ATOM 208 CD PRO A 16 66.568 -20.480 -0.353 1.00 0.00 C ATOM 0 HA PRO A 16 69.011 -18.376 0.124 1.00 0.00 H new ATOM 0 HB2 PRO A 16 66.955 -17.368 -1.448 1.00 0.00 H new ATOM 0 HB3 PRO A 16 67.995 -18.645 -2.047 1.00 0.00 H new ATOM 0 HG2 PRO A 16 65.245 -18.854 -0.836 1.00 0.00 H new ATOM 0 HG3 PRO A 16 65.898 -19.684 -2.235 1.00 0.00 H new ATOM 0 HD2 PRO A 16 65.726 -20.903 0.195 1.00 0.00 H new ATOM 0 HD3 PRO A 16 67.010 -21.289 -0.934 1.00 0.00 H new ATOM 216 N LEU A 17 68.035 -16.273 1.044 1.00 0.00 N ATOM 217 CA LEU A 17 67.622 -15.159 1.892 1.00 0.00 C ATOM 218 C LEU A 17 68.265 -13.856 1.430 1.00 0.00 C ATOM 219 O LEU A 17 69.431 -13.832 1.036 1.00 0.00 O ATOM 220 CB LEU A 17 67.995 -15.437 3.349 1.00 0.00 C ATOM 221 CG LEU A 17 69.450 -15.165 3.733 1.00 0.00 C ATOM 222 CD1 LEU A 17 69.639 -15.297 5.236 1.00 0.00 C ATOM 223 CD2 LEU A 17 70.383 -16.110 2.991 1.00 0.00 C ATOM 0 H LEU A 17 68.842 -16.076 0.452 1.00 0.00 H new ATOM 0 HA LEU A 17 66.540 -15.056 1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 17 67.352 -14.833 3.989 1.00 0.00 H new ATOM 0 HB3 LEU A 17 67.772 -16.481 3.567 1.00 0.00 H new ATOM 0 HG LEU A 17 69.697 -14.143 3.445 1.00 0.00 H new ATOM 0 HD11 LEU A 17 70.680 -15.100 5.490 1.00 0.00 H new ATOM 0 HD12 LEU A 17 68.998 -14.579 5.748 1.00 0.00 H new ATOM 0 HD13 LEU A 17 69.374 -16.307 5.549 1.00 0.00 H new ATOM 0 HD21 LEU A 17 71.414 -15.902 3.277 1.00 0.00 H new ATOM 0 HD22 LEU A 17 70.136 -17.140 3.247 1.00 0.00 H new ATOM 0 HD23 LEU A 17 70.268 -15.966 1.917 1.00 0.00 H new ATOM 235 N SER A 18 67.497 -12.772 1.483 1.00 0.00 N ATOM 236 CA SER A 18 67.991 -11.464 1.068 1.00 0.00 C ATOM 237 C SER A 18 68.125 -10.529 2.267 1.00 0.00 C ATOM 238 O SER A 18 67.241 -10.465 3.120 1.00 0.00 O ATOM 239 CB SER A 18 67.053 -10.847 0.029 1.00 0.00 C ATOM 240 OG SER A 18 67.411 -11.248 -1.282 1.00 0.00 O ATOM 0 H SER A 18 66.531 -12.774 1.809 1.00 0.00 H new ATOM 0 HA SER A 18 68.976 -11.600 0.622 1.00 0.00 H new ATOM 0 HB2 SER A 18 66.026 -11.148 0.237 1.00 0.00 H new ATOM 0 HB3 SER A 18 67.088 -9.760 0.103 1.00 0.00 H new ATOM 0 HG SER A 18 66.796 -10.842 -1.928 1.00 0.00 H new ATOM 246 N ARG A 19 69.239 -9.806 2.323 1.00 0.00 N ATOM 247 CA ARG A 19 69.491 -8.876 3.417 1.00 0.00 C ATOM 248 C ARG A 19 70.525 -7.829 3.012 1.00 0.00 C ATOM 249 O ARG A 19 71.586 -8.161 2.485 1.00 0.00 O ATOM 250 CB ARG A 19 69.973 -9.631 4.657 1.00 0.00 C ATOM 251 CG ARG A 19 70.186 -8.740 5.869 1.00 0.00 C ATOM 252 CD ARG A 19 70.853 -9.496 7.007 1.00 0.00 C ATOM 253 NE ARG A 19 71.517 -8.597 7.947 1.00 0.00 N ATOM 254 CZ ARG A 19 72.017 -8.991 9.113 1.00 0.00 C ATOM 255 NH1 ARG A 19 71.930 -10.262 9.479 1.00 0.00 N ATOM 256 NH2 ARG A 19 72.607 -8.113 9.914 1.00 0.00 N ATOM 0 H ARG A 19 69.981 -9.846 1.624 1.00 0.00 H new ATOM 0 HA ARG A 19 68.556 -8.368 3.651 1.00 0.00 H new ATOM 0 HB2 ARG A 19 69.245 -10.403 4.908 1.00 0.00 H new ATOM 0 HB3 ARG A 19 70.908 -10.139 4.422 1.00 0.00 H new ATOM 0 HG2 ARG A 19 70.801 -7.885 5.589 1.00 0.00 H new ATOM 0 HG3 ARG A 19 69.227 -8.346 6.205 1.00 0.00 H new ATOM 0 HD2 ARG A 19 70.106 -10.087 7.537 1.00 0.00 H new ATOM 0 HD3 ARG A 19 71.582 -10.196 6.599 1.00 0.00 H new ATOM 0 HE ARG A 19 71.602 -7.612 7.694 1.00 0.00 H new ATOM 0 HH11 ARG A 19 71.478 -10.940 8.865 1.00 0.00 H new ATOM 0 HH12 ARG A 19 72.315 -10.562 10.375 1.00 0.00 H new ATOM 0 HH21 ARG A 19 72.677 -7.134 9.635 1.00 0.00 H new ATOM 0 HH22 ARG A 19 72.991 -8.417 10.809 1.00 0.00 H new ATOM 270 N SER A 20 70.207 -6.563 3.263 1.00 0.00 N ATOM 271 CA SER A 20 71.106 -5.467 2.922 1.00 0.00 C ATOM 272 C SER A 20 70.638 -4.162 3.559 1.00 0.00 C ATOM 273 O SER A 20 69.613 -3.601 3.173 1.00 0.00 O ATOM 274 CB SER A 20 71.191 -5.304 1.403 1.00 0.00 C ATOM 275 OG SER A 20 72.355 -4.585 1.031 1.00 0.00 O ATOM 0 H SER A 20 69.333 -6.271 3.701 1.00 0.00 H new ATOM 0 HA SER A 20 72.096 -5.707 3.311 1.00 0.00 H new ATOM 0 HB2 SER A 20 71.199 -6.285 0.929 1.00 0.00 H new ATOM 0 HB3 SER A 20 70.306 -4.782 1.040 1.00 0.00 H new ATOM 0 HG SER A 20 72.387 -4.496 0.056 1.00 0.00 H new ATOM 281 N LYS A 21 71.399 -3.684 4.538 1.00 0.00 N ATOM 282 CA LYS A 21 71.065 -2.444 5.230 1.00 0.00 C ATOM 283 C LYS A 21 72.327 -1.725 5.696 1.00 0.00 C ATOM 284 O LYS A 21 73.308 -2.361 6.084 1.00 0.00 O ATOM 285 CB LYS A 21 70.158 -2.733 6.428 1.00 0.00 C ATOM 286 CG LYS A 21 70.789 -3.650 7.462 1.00 0.00 C ATOM 287 CD LYS A 21 69.851 -3.903 8.630 1.00 0.00 C ATOM 288 CE LYS A 21 70.256 -5.143 9.412 1.00 0.00 C ATOM 289 NZ LYS A 21 69.339 -5.402 10.556 1.00 0.00 N ATOM 0 H LYS A 21 72.251 -4.136 4.870 1.00 0.00 H new ATOM 0 HA LYS A 21 70.537 -1.797 4.530 1.00 0.00 H new ATOM 0 HB2 LYS A 21 69.890 -1.791 6.906 1.00 0.00 H new ATOM 0 HB3 LYS A 21 69.232 -3.184 6.071 1.00 0.00 H new ATOM 0 HG2 LYS A 21 71.054 -4.599 6.995 1.00 0.00 H new ATOM 0 HG3 LYS A 21 71.715 -3.205 7.827 1.00 0.00 H new ATOM 0 HD2 LYS A 21 69.852 -3.037 9.293 1.00 0.00 H new ATOM 0 HD3 LYS A 21 68.832 -4.021 8.261 1.00 0.00 H new ATOM 0 HE2 LYS A 21 70.260 -6.007 8.747 1.00 0.00 H new ATOM 0 HE3 LYS A 21 71.274 -5.022 9.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 69.649 -6.255 11.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 69.355 -4.589 11.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 68.372 -5.543 10.201 1.00 0.00 H new ATOM 303 N ARG A 22 72.295 -0.397 5.657 1.00 0.00 N ATOM 304 CA ARG A 22 73.436 0.408 6.076 1.00 0.00 C ATOM 305 C ARG A 22 73.112 1.193 7.343 1.00 0.00 C ATOM 306 O ARG A 22 71.950 1.400 7.695 1.00 0.00 O ATOM 307 CB ARG A 22 73.847 1.369 4.959 1.00 0.00 C ATOM 308 CG ARG A 22 74.851 0.776 3.984 1.00 0.00 C ATOM 309 CD ARG A 22 74.164 -0.063 2.918 1.00 0.00 C ATOM 310 NE ARG A 22 73.382 0.756 1.995 1.00 0.00 N ATOM 311 CZ ARG A 22 73.924 1.542 1.071 1.00 0.00 C ATOM 312 NH1 ARG A 22 75.242 1.614 0.947 1.00 0.00 N ATOM 313 NH2 ARG A 22 73.146 2.258 0.269 1.00 0.00 N ATOM 0 H ARG A 22 71.491 0.144 5.339 1.00 0.00 H new ATOM 0 HA ARG A 22 74.265 -0.266 6.289 1.00 0.00 H new ATOM 0 HB2 ARG A 22 72.957 1.676 4.409 1.00 0.00 H new ATOM 0 HB3 ARG A 22 74.273 2.269 5.404 1.00 0.00 H new ATOM 0 HG2 ARG A 22 75.416 1.578 3.509 1.00 0.00 H new ATOM 0 HG3 ARG A 22 75.567 0.160 4.528 1.00 0.00 H new ATOM 0 HD2 ARG A 22 74.914 -0.623 2.359 1.00 0.00 H new ATOM 0 HD3 ARG A 22 73.511 -0.793 3.396 1.00 0.00 H new ATOM 0 HE ARG A 22 72.365 0.723 2.064 1.00 0.00 H new ATOM 0 HH11 ARG A 22 75.843 1.065 1.562 1.00 0.00 H new ATOM 0 HH12 ARG A 22 75.655 2.218 0.237 1.00 0.00 H new ATOM 0 HH21 ARG A 22 72.132 2.205 0.362 1.00 0.00 H new ATOM 0 HH22 ARG A 22 73.562 2.861 -0.440 1.00 0.00 H new ATOM 327 N PRO A 23 74.162 1.641 8.047 1.00 0.00 N ATOM 328 CA PRO A 23 74.014 2.411 9.286 1.00 0.00 C ATOM 329 C PRO A 23 73.460 3.809 9.037 1.00 0.00 C ATOM 330 O PRO A 23 73.405 4.272 7.898 1.00 0.00 O ATOM 331 CB PRO A 23 75.444 2.491 9.826 1.00 0.00 C ATOM 332 CG PRO A 23 76.312 2.348 8.624 1.00 0.00 C ATOM 333 CD PRO A 23 75.574 1.432 7.687 1.00 0.00 C ATOM 0 HA PRO A 23 73.309 1.945 9.974 1.00 0.00 H new ATOM 0 HB2 PRO A 23 75.623 3.439 10.333 1.00 0.00 H new ATOM 0 HB3 PRO A 23 75.638 1.700 10.551 1.00 0.00 H new ATOM 0 HG2 PRO A 23 76.497 3.316 8.159 1.00 0.00 H new ATOM 0 HG3 PRO A 23 77.284 1.932 8.891 1.00 0.00 H new ATOM 0 HD2 PRO A 23 75.765 1.686 6.644 1.00 0.00 H new ATOM 0 HD3 PRO A 23 75.874 0.393 7.822 1.00 0.00 H new ATOM 341 N ASP A 24 73.049 4.477 10.110 1.00 0.00 N ATOM 342 CA ASP A 24 72.500 5.824 10.008 1.00 0.00 C ATOM 343 C ASP A 24 73.609 6.870 10.071 1.00 0.00 C ATOM 344 O ASP A 24 74.071 7.235 11.153 1.00 0.00 O ATOM 345 CB ASP A 24 71.486 6.070 11.126 1.00 0.00 C ATOM 346 CG ASP A 24 71.174 7.542 11.311 1.00 0.00 C ATOM 347 OD1 ASP A 24 71.103 8.266 10.295 1.00 0.00 O ATOM 348 OD2 ASP A 24 70.999 7.970 12.471 1.00 0.00 O ATOM 0 H ASP A 24 73.086 4.107 11.060 1.00 0.00 H new ATOM 0 HA ASP A 24 71.997 5.912 9.045 1.00 0.00 H new ATOM 0 HB2 ASP A 24 70.565 5.532 10.902 1.00 0.00 H new ATOM 0 HB3 ASP A 24 71.874 5.664 12.060 1.00 0.00 H new ATOM 353 N PHE A 25 74.033 7.346 8.906 1.00 0.00 N ATOM 354 CA PHE A 25 75.090 8.348 8.829 1.00 0.00 C ATOM 355 C PHE A 25 74.506 9.758 8.856 1.00 0.00 C ATOM 356 O PHE A 25 74.871 10.608 8.045 1.00 0.00 O ATOM 357 CB PHE A 25 75.917 8.151 7.557 1.00 0.00 C ATOM 358 CG PHE A 25 77.324 8.665 7.671 1.00 0.00 C ATOM 359 CD1 PHE A 25 78.296 7.922 8.321 1.00 0.00 C ATOM 360 CD2 PHE A 25 77.674 9.891 7.128 1.00 0.00 C ATOM 361 CE1 PHE A 25 79.592 8.392 8.427 1.00 0.00 C ATOM 362 CE2 PHE A 25 78.968 10.365 7.230 1.00 0.00 C ATOM 363 CZ PHE A 25 79.928 9.615 7.882 1.00 0.00 C ATOM 0 H PHE A 25 73.661 7.055 8.002 1.00 0.00 H new ATOM 0 HA PHE A 25 75.737 8.225 9.698 1.00 0.00 H new ATOM 0 HB2 PHE A 25 75.945 7.089 7.312 1.00 0.00 H new ATOM 0 HB3 PHE A 25 75.420 8.656 6.728 1.00 0.00 H new ATOM 0 HD1 PHE A 25 78.038 6.965 8.750 1.00 0.00 H new ATOM 0 HD2 PHE A 25 76.927 10.483 6.619 1.00 0.00 H new ATOM 0 HE1 PHE A 25 80.341 7.803 8.936 1.00 0.00 H new ATOM 0 HE2 PHE A 25 79.229 11.321 6.800 1.00 0.00 H new ATOM 0 HZ PHE A 25 80.939 9.985 7.965 1.00 0.00 H new ATOM 373 N GLY A 26 73.596 9.997 9.795 1.00 0.00 N ATOM 374 CA GLY A 26 72.975 11.304 9.911 1.00 0.00 C ATOM 375 C GLY A 26 73.432 12.056 11.145 1.00 0.00 C ATOM 376 O GLY A 26 72.617 12.630 11.866 1.00 0.00 O ATOM 0 H GLY A 26 73.278 9.309 10.478 1.00 0.00 H new ATOM 0 HA2 GLY A 26 73.207 11.893 9.024 1.00 0.00 H new ATOM 0 HA3 GLY A 26 71.892 11.187 9.941 1.00 0.00 H new ATOM 380 N GLN A 27 74.739 12.052 11.389 1.00 0.00 N ATOM 381 CA GLN A 27 75.302 12.737 12.546 1.00 0.00 C ATOM 382 C GLN A 27 76.390 13.718 12.122 1.00 0.00 C ATOM 383 O GLN A 27 77.291 14.035 12.899 1.00 0.00 O ATOM 384 CB GLN A 27 75.872 11.722 13.538 1.00 0.00 C ATOM 385 CG GLN A 27 75.834 12.196 14.982 1.00 0.00 C ATOM 386 CD GLN A 27 76.550 11.251 15.926 1.00 0.00 C ATOM 387 OE1 GLN A 27 77.598 11.583 16.480 1.00 0.00 O ATOM 388 NE2 GLN A 27 75.986 10.063 16.115 1.00 0.00 N ATOM 0 H GLN A 27 75.427 11.582 10.801 1.00 0.00 H new ATOM 0 HA GLN A 27 74.502 13.297 13.030 1.00 0.00 H new ATOM 0 HB2 GLN A 27 75.311 10.791 13.455 1.00 0.00 H new ATOM 0 HB3 GLN A 27 76.903 11.499 13.265 1.00 0.00 H new ATOM 0 HG2 GLN A 27 76.290 13.184 15.048 1.00 0.00 H new ATOM 0 HG3 GLN A 27 74.796 12.302 15.298 1.00 0.00 H new ATOM 0 HE21 GLN A 27 75.117 9.829 15.635 1.00 0.00 H new ATOM 0 HE22 GLN A 27 76.422 9.385 16.740 1.00 0.00 H new ATOM 397 N ARG A 28 76.300 14.195 10.884 1.00 0.00 N ATOM 398 CA ARG A 28 77.278 15.138 10.356 1.00 0.00 C ATOM 399 C ARG A 28 76.868 16.575 10.663 1.00 0.00 C ATOM 400 O ARG A 28 76.624 17.369 9.755 1.00 0.00 O ATOM 401 CB ARG A 28 77.434 14.952 8.846 1.00 0.00 C ATOM 402 CG ARG A 28 78.726 15.530 8.291 1.00 0.00 C ATOM 403 CD ARG A 28 79.057 14.944 6.927 1.00 0.00 C ATOM 404 NE ARG A 28 78.074 15.322 5.916 1.00 0.00 N ATOM 405 CZ ARG A 28 77.927 14.685 4.759 1.00 0.00 C ATOM 406 NH1 ARG A 28 78.696 13.644 4.470 1.00 0.00 N ATOM 407 NH2 ARG A 28 77.010 15.089 3.890 1.00 0.00 N ATOM 0 H ARG A 28 75.560 13.944 10.229 1.00 0.00 H new ATOM 0 HA ARG A 28 78.234 14.940 10.840 1.00 0.00 H new ATOM 0 HB2 ARG A 28 77.393 13.888 8.613 1.00 0.00 H new ATOM 0 HB3 ARG A 28 76.590 15.422 8.341 1.00 0.00 H new ATOM 0 HG2 ARG A 28 78.637 16.613 8.211 1.00 0.00 H new ATOM 0 HG3 ARG A 28 79.543 15.328 8.983 1.00 0.00 H new ATOM 0 HD2 ARG A 28 80.045 15.284 6.617 1.00 0.00 H new ATOM 0 HD3 ARG A 28 79.102 13.857 7.000 1.00 0.00 H new ATOM 0 HE ARG A 28 77.467 16.119 6.108 1.00 0.00 H new ATOM 0 HH11 ARG A 28 79.402 13.331 5.136 1.00 0.00 H new ATOM 0 HH12 ARG A 28 78.582 13.156 3.581 1.00 0.00 H new ATOM 0 HH21 ARG A 28 76.417 15.889 4.110 1.00 0.00 H new ATOM 0 HH22 ARG A 28 76.898 14.599 3.002 1.00 0.00 H new ATOM 421 N ARG A 29 76.794 16.902 11.949 1.00 0.00 N ATOM 422 CA ARG A 29 76.411 18.243 12.376 1.00 0.00 C ATOM 423 C ARG A 29 77.643 19.116 12.595 1.00 0.00 C ATOM 424 O ARG A 29 77.722 19.861 13.572 1.00 0.00 O ATOM 425 CB ARG A 29 75.586 18.175 13.662 1.00 0.00 C ATOM 426 CG ARG A 29 76.334 17.563 14.835 1.00 0.00 C ATOM 427 CD ARG A 29 75.611 17.813 16.149 1.00 0.00 C ATOM 428 NE ARG A 29 76.023 16.873 17.188 1.00 0.00 N ATOM 429 CZ ARG A 29 75.417 16.766 18.365 1.00 0.00 C ATOM 430 NH1 ARG A 29 74.376 17.536 18.651 1.00 0.00 N ATOM 431 NH2 ARG A 29 75.851 15.887 19.259 1.00 0.00 N ATOM 0 H ARG A 29 76.994 16.257 12.713 1.00 0.00 H new ATOM 0 HA ARG A 29 75.806 18.690 11.587 1.00 0.00 H new ATOM 0 HB2 ARG A 29 75.266 19.181 13.932 1.00 0.00 H new ATOM 0 HB3 ARG A 29 74.684 17.593 13.474 1.00 0.00 H new ATOM 0 HG2 ARG A 29 76.444 16.490 14.678 1.00 0.00 H new ATOM 0 HG3 ARG A 29 77.339 17.983 14.886 1.00 0.00 H new ATOM 0 HD2 ARG A 29 75.808 18.832 16.483 1.00 0.00 H new ATOM 0 HD3 ARG A 29 74.535 17.731 15.992 1.00 0.00 H new ATOM 0 HE ARG A 29 76.820 16.265 16.999 1.00 0.00 H new ATOM 0 HH11 ARG A 29 74.039 18.213 17.966 1.00 0.00 H new ATOM 0 HH12 ARG A 29 73.913 17.452 19.556 1.00 0.00 H new ATOM 0 HH21 ARG A 29 76.651 15.292 19.043 1.00 0.00 H new ATOM 0 HH22 ARG A 29 75.385 15.806 20.163 1.00 0.00 H new ATOM 445 N ILE A 30 78.602 19.017 11.680 1.00 0.00 N ATOM 446 CA ILE A 30 79.829 19.798 11.773 1.00 0.00 C ATOM 447 C ILE A 30 79.611 21.226 11.285 1.00 0.00 C ATOM 448 O ILE A 30 79.529 21.476 10.083 1.00 0.00 O ATOM 449 CB ILE A 30 80.967 19.157 10.957 1.00 0.00 C ATOM 450 CG1 ILE A 30 81.550 17.957 11.707 1.00 0.00 C ATOM 451 CG2 ILE A 30 82.052 20.183 10.665 1.00 0.00 C ATOM 452 CD1 ILE A 30 80.588 16.795 11.828 1.00 0.00 C ATOM 0 H ILE A 30 78.553 18.404 10.866 1.00 0.00 H new ATOM 0 HA ILE A 30 80.112 19.816 12.825 1.00 0.00 H new ATOM 0 HB ILE A 30 80.560 18.806 10.009 1.00 0.00 H new ATOM 0 HG12 ILE A 30 82.451 17.621 11.194 1.00 0.00 H new ATOM 0 HG13 ILE A 30 81.852 18.274 12.705 1.00 0.00 H new ATOM 0 HG21 ILE A 30 82.849 19.715 10.088 1.00 0.00 H new ATOM 0 HG22 ILE A 30 81.628 21.009 10.094 1.00 0.00 H new ATOM 0 HG23 ILE A 30 82.457 20.561 11.604 1.00 0.00 H new ATOM 0 HD11 ILE A 30 81.068 15.980 12.370 1.00 0.00 H new ATOM 0 HD12 ILE A 30 79.697 17.115 12.368 1.00 0.00 H new ATOM 0 HD13 ILE A 30 80.305 16.451 10.833 1.00 0.00 H new ATOM 464 N ARG A 31 79.519 22.159 12.227 1.00 0.00 N ATOM 465 CA ARG A 31 79.310 23.563 11.893 1.00 0.00 C ATOM 466 C ARG A 31 80.537 24.395 12.253 1.00 0.00 C ATOM 467 O ARG A 31 80.612 24.972 13.338 1.00 0.00 O ATOM 468 CB ARG A 31 78.081 24.106 12.623 1.00 0.00 C ATOM 469 CG ARG A 31 76.797 23.365 12.287 1.00 0.00 C ATOM 470 CD ARG A 31 75.828 23.369 13.460 1.00 0.00 C ATOM 471 NE ARG A 31 76.248 22.457 14.520 1.00 0.00 N ATOM 472 CZ ARG A 31 75.730 22.463 15.743 1.00 0.00 C ATOM 473 NH1 ARG A 31 74.777 23.329 16.058 1.00 0.00 N ATOM 474 NH2 ARG A 31 76.165 21.601 16.653 1.00 0.00 N ATOM 0 H ARG A 31 79.586 21.968 13.227 1.00 0.00 H new ATOM 0 HA ARG A 31 79.146 23.634 10.818 1.00 0.00 H new ATOM 0 HB2 ARG A 31 78.253 24.049 13.698 1.00 0.00 H new ATOM 0 HB3 ARG A 31 77.958 25.160 12.375 1.00 0.00 H new ATOM 0 HG2 ARG A 31 76.324 23.829 11.421 1.00 0.00 H new ATOM 0 HG3 ARG A 31 77.031 22.337 12.010 1.00 0.00 H new ATOM 0 HD2 ARG A 31 75.749 24.379 13.861 1.00 0.00 H new ATOM 0 HD3 ARG A 31 74.835 23.086 13.111 1.00 0.00 H new ATOM 0 HE ARG A 31 76.979 21.778 14.310 1.00 0.00 H new ATOM 0 HH11 ARG A 31 74.440 23.993 15.360 1.00 0.00 H new ATOM 0 HH12 ARG A 31 74.381 23.332 16.998 1.00 0.00 H new ATOM 0 HH21 ARG A 31 76.898 20.933 16.414 1.00 0.00 H new ATOM 0 HH22 ARG A 31 75.767 21.606 17.592 1.00 0.00 H new ATOM 488 N ARG A 32 81.497 24.453 11.335 1.00 0.00 N ATOM 489 CA ARG A 32 82.721 25.213 11.557 1.00 0.00 C ATOM 490 C ARG A 32 82.423 26.705 11.662 1.00 0.00 C ATOM 491 O ARG A 32 81.376 27.187 11.228 1.00 0.00 O ATOM 492 CB ARG A 32 83.716 24.960 10.422 1.00 0.00 C ATOM 493 CG ARG A 32 84.688 23.826 10.706 1.00 0.00 C ATOM 494 CD ARG A 32 86.060 24.107 10.113 1.00 0.00 C ATOM 495 NE ARG A 32 87.125 23.439 10.857 1.00 0.00 N ATOM 496 CZ ARG A 32 88.329 23.191 10.353 1.00 0.00 C ATOM 497 NH1 ARG A 32 88.619 23.553 9.111 1.00 0.00 N ATOM 498 NH2 ARG A 32 89.245 22.579 11.092 1.00 0.00 N ATOM 0 H ARG A 32 81.450 23.983 10.431 1.00 0.00 H new ATOM 0 HA ARG A 32 83.160 24.880 12.498 1.00 0.00 H new ATOM 0 HB2 ARG A 32 83.164 24.734 9.510 1.00 0.00 H new ATOM 0 HB3 ARG A 32 84.281 25.873 10.235 1.00 0.00 H new ATOM 0 HG2 ARG A 32 84.778 23.684 11.783 1.00 0.00 H new ATOM 0 HG3 ARG A 32 84.295 22.897 10.293 1.00 0.00 H new ATOM 0 HD2 ARG A 32 86.081 23.776 9.075 1.00 0.00 H new ATOM 0 HD3 ARG A 32 86.240 25.182 10.109 1.00 0.00 H new ATOM 0 HE ARG A 32 86.934 23.147 11.815 1.00 0.00 H new ATOM 0 HH11 ARG A 32 87.917 24.023 8.540 1.00 0.00 H new ATOM 0 HH12 ARG A 32 89.544 23.361 8.727 1.00 0.00 H new ATOM 0 HH21 ARG A 32 89.025 22.299 12.048 1.00 0.00 H new ATOM 0 HH22 ARG A 32 90.169 22.389 10.704 1.00 0.00 H new ATOM 512 N PRO A 33 83.363 27.457 12.255 1.00 0.00 N ATOM 513 CA PRO A 33 83.224 28.905 12.432 1.00 0.00 C ATOM 514 C PRO A 33 83.312 29.662 11.111 1.00 0.00 C ATOM 515 O PRO A 33 84.313 29.573 10.399 1.00 0.00 O ATOM 516 CB PRO A 33 84.405 29.267 13.335 1.00 0.00 C ATOM 517 CG PRO A 33 85.416 28.203 13.082 1.00 0.00 C ATOM 518 CD PRO A 33 84.635 26.950 12.796 1.00 0.00 C ATOM 0 HA PRO A 33 82.253 29.173 12.849 1.00 0.00 H new ATOM 0 HB2 PRO A 33 84.800 30.254 13.093 1.00 0.00 H new ATOM 0 HB3 PRO A 33 84.109 29.290 14.384 1.00 0.00 H new ATOM 0 HG2 PRO A 33 86.056 28.465 12.239 1.00 0.00 H new ATOM 0 HG3 PRO A 33 86.066 28.069 13.946 1.00 0.00 H new ATOM 0 HD2 PRO A 33 85.150 26.310 12.079 1.00 0.00 H new ATOM 0 HD3 PRO A 33 84.481 26.358 13.698 1.00 0.00 H new ATOM 526 N PHE A 34 82.259 30.406 10.789 1.00 0.00 N ATOM 527 CA PHE A 34 82.218 31.178 9.552 1.00 0.00 C ATOM 528 C PHE A 34 82.134 32.672 9.847 1.00 0.00 C ATOM 529 O PHE A 34 81.810 33.081 10.963 1.00 0.00 O ATOM 530 CB PHE A 34 81.024 30.747 8.697 1.00 0.00 C ATOM 531 CG PHE A 34 79.807 30.391 9.502 1.00 0.00 C ATOM 532 CD1 PHE A 34 79.268 31.295 10.404 1.00 0.00 C ATOM 533 CD2 PHE A 34 79.203 29.153 9.358 1.00 0.00 C ATOM 534 CE1 PHE A 34 78.148 30.970 11.146 1.00 0.00 C ATOM 535 CE2 PHE A 34 78.082 28.823 10.097 1.00 0.00 C ATOM 536 CZ PHE A 34 77.555 29.733 10.993 1.00 0.00 C ATOM 0 H PHE A 34 81.423 30.491 11.367 1.00 0.00 H new ATOM 0 HA PHE A 34 83.139 30.986 9.001 1.00 0.00 H new ATOM 0 HB2 PHE A 34 80.771 31.553 8.008 1.00 0.00 H new ATOM 0 HB3 PHE A 34 81.313 29.888 8.091 1.00 0.00 H new ATOM 0 HD1 PHE A 34 79.728 32.264 10.528 1.00 0.00 H new ATOM 0 HD2 PHE A 34 79.612 28.437 8.660 1.00 0.00 H new ATOM 0 HE1 PHE A 34 77.737 31.683 11.845 1.00 0.00 H new ATOM 0 HE2 PHE A 34 77.619 27.855 9.974 1.00 0.00 H new ATOM 0 HZ PHE A 34 76.681 29.477 11.573 1.00 0.00 H new ATOM 546 N THR A 35 82.428 33.486 8.837 1.00 0.00 N ATOM 547 CA THR A 35 82.389 34.935 8.987 1.00 0.00 C ATOM 548 C THR A 35 81.136 35.520 8.344 1.00 0.00 C ATOM 549 O THR A 35 80.558 34.926 7.434 1.00 0.00 O ATOM 550 CB THR A 35 83.630 35.599 8.362 1.00 0.00 C ATOM 551 OG1 THR A 35 84.776 34.759 8.540 1.00 0.00 O ATOM 552 CG2 THR A 35 83.890 36.960 8.990 1.00 0.00 C ATOM 0 H THR A 35 82.696 33.166 7.906 1.00 0.00 H new ATOM 0 HA THR A 35 82.376 35.142 10.057 1.00 0.00 H new ATOM 0 HB THR A 35 83.443 35.738 7.297 1.00 0.00 H new ATOM 0 HG1 THR A 35 85.561 35.187 8.139 1.00 0.00 H new ATOM 0 HG21 THR A 35 84.771 37.409 8.532 1.00 0.00 H new ATOM 0 HG22 THR A 35 83.027 37.606 8.828 1.00 0.00 H new ATOM 0 HG23 THR A 35 84.058 36.841 10.060 1.00 0.00 H new ATOM 560 N VAL A 36 80.722 36.689 8.822 1.00 0.00 N ATOM 561 CA VAL A 36 79.539 37.356 8.293 1.00 0.00 C ATOM 562 C VAL A 36 79.606 37.471 6.774 1.00 0.00 C ATOM 563 O VAL A 36 78.599 37.317 6.084 1.00 0.00 O ATOM 564 CB VAL A 36 79.369 38.763 8.897 1.00 0.00 C ATOM 565 CG1 VAL A 36 80.620 39.597 8.665 1.00 0.00 C ATOM 566 CG2 VAL A 36 78.145 39.449 8.311 1.00 0.00 C ATOM 0 H VAL A 36 81.189 37.194 9.575 1.00 0.00 H new ATOM 0 HA VAL A 36 78.681 36.744 8.571 1.00 0.00 H new ATOM 0 HB VAL A 36 79.221 38.663 9.972 1.00 0.00 H new ATOM 0 HG11 VAL A 36 80.482 40.588 9.098 1.00 0.00 H new ATOM 0 HG12 VAL A 36 81.474 39.111 9.136 1.00 0.00 H new ATOM 0 HG13 VAL A 36 80.801 39.691 7.594 1.00 0.00 H new ATOM 0 HG21 VAL A 36 78.040 40.442 8.749 1.00 0.00 H new ATOM 0 HG22 VAL A 36 78.261 39.539 7.231 1.00 0.00 H new ATOM 0 HG23 VAL A 36 77.256 38.859 8.533 1.00 0.00 H new ATOM 576 N ALA A 37 80.801 37.743 6.260 1.00 0.00 N ATOM 577 CA ALA A 37 81.001 37.877 4.822 1.00 0.00 C ATOM 578 C ALA A 37 80.881 36.527 4.123 1.00 0.00 C ATOM 579 O ALA A 37 80.172 36.395 3.126 1.00 0.00 O ATOM 580 CB ALA A 37 82.357 38.504 4.534 1.00 0.00 C ATOM 0 H ALA A 37 81.645 37.875 6.818 1.00 0.00 H new ATOM 0 HA ALA A 37 80.221 38.530 4.431 1.00 0.00 H new ATOM 0 HB1 ALA A 37 82.493 38.598 3.457 1.00 0.00 H new ATOM 0 HB2 ALA A 37 82.406 39.491 4.994 1.00 0.00 H new ATOM 0 HB3 ALA A 37 83.145 37.873 4.945 1.00 0.00 H new ATOM 586 N GLU A 38 81.579 35.527 4.653 1.00 0.00 N ATOM 587 CA GLU A 38 81.551 34.187 4.078 1.00 0.00 C ATOM 588 C GLU A 38 80.130 33.631 4.064 1.00 0.00 C ATOM 589 O GLU A 38 79.693 33.039 3.077 1.00 0.00 O ATOM 590 CB GLU A 38 82.470 33.251 4.865 1.00 0.00 C ATOM 591 CG GLU A 38 82.568 31.855 4.273 1.00 0.00 C ATOM 592 CD GLU A 38 82.862 30.797 5.318 1.00 0.00 C ATOM 593 OE1 GLU A 38 83.733 31.041 6.180 1.00 0.00 O ATOM 594 OE2 GLU A 38 82.222 29.726 5.276 1.00 0.00 O ATOM 0 H GLU A 38 82.170 35.619 5.479 1.00 0.00 H new ATOM 0 HA GLU A 38 81.907 34.253 3.050 1.00 0.00 H new ATOM 0 HB2 GLU A 38 83.467 33.688 4.910 1.00 0.00 H new ATOM 0 HB3 GLU A 38 82.108 33.177 5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 38 81.633 31.612 3.769 1.00 0.00 H new ATOM 0 HG3 GLU A 38 83.352 31.840 3.516 1.00 0.00 H new ATOM 601 N VAL A 39 79.414 33.826 5.167 1.00 0.00 N ATOM 602 CA VAL A 39 78.043 33.345 5.283 1.00 0.00 C ATOM 603 C VAL A 39 77.120 34.075 4.313 1.00 0.00 C ATOM 604 O VAL A 39 76.248 33.467 3.694 1.00 0.00 O ATOM 605 CB VAL A 39 77.506 33.519 6.716 1.00 0.00 C ATOM 606 CG1 VAL A 39 76.059 33.057 6.804 1.00 0.00 C ATOM 607 CG2 VAL A 39 78.377 32.763 7.707 1.00 0.00 C ATOM 0 H VAL A 39 79.761 34.314 5.993 1.00 0.00 H new ATOM 0 HA VAL A 39 78.058 32.284 5.036 1.00 0.00 H new ATOM 0 HB VAL A 39 77.540 34.578 6.972 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.697 33.187 7.824 1.00 0.00 H new ATOM 0 HG12 VAL A 39 75.446 33.648 6.123 1.00 0.00 H new ATOM 0 HG13 VAL A 39 75.996 32.004 6.528 1.00 0.00 H new ATOM 0 HG21 VAL A 39 77.983 32.897 8.714 1.00 0.00 H new ATOM 0 HG22 VAL A 39 78.377 31.702 7.456 1.00 0.00 H new ATOM 0 HG23 VAL A 39 79.396 33.147 7.662 1.00 0.00 H new ATOM 617 N GLU A 40 77.320 35.383 4.187 1.00 0.00 N ATOM 618 CA GLU A 40 76.505 36.197 3.293 1.00 0.00 C ATOM 619 C GLU A 40 76.577 35.672 1.862 1.00 0.00 C ATOM 620 O GLU A 40 75.551 35.428 1.225 1.00 0.00 O ATOM 621 CB GLU A 40 76.963 37.657 3.336 1.00 0.00 C ATOM 622 CG GLU A 40 76.346 38.455 4.472 1.00 0.00 C ATOM 623 CD GLU A 40 77.046 39.781 4.700 1.00 0.00 C ATOM 624 OE1 GLU A 40 78.286 39.780 4.844 1.00 0.00 O ATOM 625 OE2 GLU A 40 76.353 40.820 4.733 1.00 0.00 O ATOM 0 H GLU A 40 78.039 35.901 4.692 1.00 0.00 H new ATOM 0 HA GLU A 40 75.471 36.138 3.632 1.00 0.00 H new ATOM 0 HB2 GLU A 40 78.049 37.686 3.431 1.00 0.00 H new ATOM 0 HB3 GLU A 40 76.713 38.136 2.389 1.00 0.00 H new ATOM 0 HG2 GLU A 40 75.294 38.637 4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 40 76.385 37.866 5.388 1.00 0.00 H new ATOM 632 N LEU A 41 77.796 35.500 1.362 1.00 0.00 N ATOM 633 CA LEU A 41 78.004 35.004 0.006 1.00 0.00 C ATOM 634 C LEU A 41 77.410 33.609 -0.160 1.00 0.00 C ATOM 635 O LEU A 41 76.697 33.337 -1.127 1.00 0.00 O ATOM 636 CB LEU A 41 79.497 34.978 -0.326 1.00 0.00 C ATOM 637 CG LEU A 41 80.245 36.301 -0.158 1.00 0.00 C ATOM 638 CD1 LEU A 41 81.739 36.056 -0.020 1.00 0.00 C ATOM 639 CD2 LEU A 41 79.960 37.227 -1.332 1.00 0.00 C ATOM 0 H LEU A 41 78.655 35.697 1.875 1.00 0.00 H new ATOM 0 HA LEU A 41 77.497 35.679 -0.683 1.00 0.00 H new ATOM 0 HB2 LEU A 41 79.976 34.230 0.306 1.00 0.00 H new ATOM 0 HB3 LEU A 41 79.614 34.646 -1.358 1.00 0.00 H new ATOM 0 HG LEU A 41 79.892 36.783 0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 41 82.255 37.009 0.099 1.00 0.00 H new ATOM 0 HD12 LEU A 41 81.926 35.431 0.853 1.00 0.00 H new ATOM 0 HD13 LEU A 41 82.109 35.552 -0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 41 80.500 38.164 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU A 41 80.285 36.752 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 41 78.890 37.429 -1.384 1.00 0.00 H new ATOM 651 N LEU A 42 77.707 32.728 0.789 1.00 0.00 N ATOM 652 CA LEU A 42 77.200 31.361 0.749 1.00 0.00 C ATOM 653 C LEU A 42 75.678 31.346 0.647 1.00 0.00 C ATOM 654 O LEU A 42 75.116 30.859 -0.334 1.00 0.00 O ATOM 655 CB LEU A 42 77.646 30.594 1.996 1.00 0.00 C ATOM 656 CG LEU A 42 76.775 29.405 2.400 1.00 0.00 C ATOM 657 CD1 LEU A 42 76.712 28.383 1.276 1.00 0.00 C ATOM 658 CD2 LEU A 42 77.304 28.766 3.676 1.00 0.00 C ATOM 0 H LEU A 42 78.296 32.936 1.595 1.00 0.00 H new ATOM 0 HA LEU A 42 77.610 30.874 -0.136 1.00 0.00 H new ATOM 0 HB2 LEU A 42 78.662 30.235 1.833 1.00 0.00 H new ATOM 0 HB3 LEU A 42 77.684 31.292 2.833 1.00 0.00 H new ATOM 0 HG LEU A 42 75.765 29.767 2.591 1.00 0.00 H new ATOM 0 HD11 LEU A 42 76.087 27.544 1.582 1.00 0.00 H new ATOM 0 HD12 LEU A 42 76.286 28.847 0.386 1.00 0.00 H new ATOM 0 HD13 LEU A 42 77.717 28.025 1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 42 76.672 27.921 3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 42 78.324 28.418 3.513 1.00 0.00 H new ATOM 0 HD23 LEU A 42 77.296 29.501 4.481 1.00 0.00 H new ATOM 670 N VAL A 43 75.017 31.886 1.666 1.00 0.00 N ATOM 671 CA VAL A 43 73.560 31.938 1.690 1.00 0.00 C ATOM 672 C VAL A 43 73.013 32.599 0.430 1.00 0.00 C ATOM 673 O VAL A 43 72.090 32.085 -0.202 1.00 0.00 O ATOM 674 CB VAL A 43 73.046 32.705 2.923 1.00 0.00 C ATOM 675 CG1 VAL A 43 71.528 32.643 2.995 1.00 0.00 C ATOM 676 CG2 VAL A 43 73.672 32.150 4.194 1.00 0.00 C ATOM 0 H VAL A 43 75.467 32.294 2.486 1.00 0.00 H new ATOM 0 HA VAL A 43 73.207 30.908 1.739 1.00 0.00 H new ATOM 0 HB VAL A 43 73.339 33.751 2.828 1.00 0.00 H new ATOM 0 HG11 VAL A 43 71.183 33.190 3.872 1.00 0.00 H new ATOM 0 HG12 VAL A 43 71.103 33.091 2.097 1.00 0.00 H new ATOM 0 HG13 VAL A 43 71.209 31.603 3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 43 73.298 32.703 5.055 1.00 0.00 H new ATOM 0 HG22 VAL A 43 73.411 31.097 4.298 1.00 0.00 H new ATOM 0 HG23 VAL A 43 74.756 32.252 4.140 1.00 0.00 H new ATOM 686 N GLU A 44 73.590 33.741 0.069 1.00 0.00 N ATOM 687 CA GLU A 44 73.159 34.472 -1.117 1.00 0.00 C ATOM 688 C GLU A 44 73.344 33.628 -2.374 1.00 0.00 C ATOM 689 O GLU A 44 72.646 33.816 -3.369 1.00 0.00 O ATOM 690 CB GLU A 44 73.942 35.781 -1.248 1.00 0.00 C ATOM 691 CG GLU A 44 73.351 36.744 -2.264 1.00 0.00 C ATOM 692 CD GLU A 44 74.010 38.109 -2.226 1.00 0.00 C ATOM 693 OE1 GLU A 44 75.233 38.170 -1.979 1.00 0.00 O ATOM 694 OE2 GLU A 44 73.303 39.116 -2.442 1.00 0.00 O ATOM 0 H GLU A 44 74.356 34.179 0.580 1.00 0.00 H new ATOM 0 HA GLU A 44 72.099 34.700 -1.007 1.00 0.00 H new ATOM 0 HB2 GLU A 44 73.980 36.271 -0.275 1.00 0.00 H new ATOM 0 HB3 GLU A 44 74.970 35.553 -1.531 1.00 0.00 H new ATOM 0 HG2 GLU A 44 73.456 36.322 -3.263 1.00 0.00 H new ATOM 0 HG3 GLU A 44 72.283 36.855 -2.076 1.00 0.00 H new ATOM 701 N ALA A 45 74.291 32.696 -2.320 1.00 0.00 N ATOM 702 CA ALA A 45 74.567 31.822 -3.453 1.00 0.00 C ATOM 703 C ALA A 45 73.493 30.749 -3.593 1.00 0.00 C ATOM 704 O ALA A 45 72.963 30.525 -4.681 1.00 0.00 O ATOM 705 CB ALA A 45 75.939 31.181 -3.302 1.00 0.00 C ATOM 0 H ALA A 45 74.879 32.527 -1.504 1.00 0.00 H new ATOM 0 HA ALA A 45 74.558 32.428 -4.359 1.00 0.00 H new ATOM 0 HB1 ALA A 45 76.133 30.531 -4.155 1.00 0.00 H new ATOM 0 HB2 ALA A 45 76.701 31.959 -3.258 1.00 0.00 H new ATOM 0 HB3 ALA A 45 75.967 30.594 -2.384 1.00 0.00 H new ATOM 711 N VAL A 46 73.177 30.086 -2.485 1.00 0.00 N ATOM 712 CA VAL A 46 72.165 29.036 -2.484 1.00 0.00 C ATOM 713 C VAL A 46 70.764 29.623 -2.616 1.00 0.00 C ATOM 714 O VAL A 46 69.881 29.015 -3.219 1.00 0.00 O ATOM 715 CB VAL A 46 72.236 28.189 -1.199 1.00 0.00 C ATOM 716 CG1 VAL A 46 72.206 29.083 0.032 1.00 0.00 C ATOM 717 CG2 VAL A 46 71.098 27.181 -1.164 1.00 0.00 C ATOM 0 H VAL A 46 73.607 30.257 -1.576 1.00 0.00 H new ATOM 0 HA VAL A 46 72.371 28.397 -3.343 1.00 0.00 H new ATOM 0 HB VAL A 46 73.178 27.640 -1.197 1.00 0.00 H new ATOM 0 HG11 VAL A 46 72.257 28.467 0.930 1.00 0.00 H new ATOM 0 HG12 VAL A 46 73.058 29.763 0.009 1.00 0.00 H new ATOM 0 HG13 VAL A 46 71.282 29.660 0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 46 71.163 26.591 -0.250 1.00 0.00 H new ATOM 0 HG22 VAL A 46 70.144 27.708 -1.189 1.00 0.00 H new ATOM 0 HG23 VAL A 46 71.170 26.521 -2.028 1.00 0.00 H new ATOM 727 N GLU A 47 70.569 30.809 -2.049 1.00 0.00 N ATOM 728 CA GLU A 47 69.274 31.478 -2.104 1.00 0.00 C ATOM 729 C GLU A 47 68.978 31.976 -3.515 1.00 0.00 C ATOM 730 O GLU A 47 67.821 32.060 -3.926 1.00 0.00 O ATOM 731 CB GLU A 47 69.239 32.650 -1.120 1.00 0.00 C ATOM 732 CG GLU A 47 69.773 33.948 -1.700 1.00 0.00 C ATOM 733 CD GLU A 47 68.716 34.726 -2.461 1.00 0.00 C ATOM 734 OE1 GLU A 47 67.525 34.615 -2.103 1.00 0.00 O ATOM 735 OE2 GLU A 47 69.082 35.446 -3.413 1.00 0.00 O ATOM 0 H GLU A 47 71.290 31.326 -1.547 1.00 0.00 H new ATOM 0 HA GLU A 47 68.508 30.755 -1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 47 68.212 32.805 -0.789 1.00 0.00 H new ATOM 0 HB3 GLU A 47 69.822 32.389 -0.237 1.00 0.00 H new ATOM 0 HG2 GLU A 47 70.165 34.568 -0.894 1.00 0.00 H new ATOM 0 HG3 GLU A 47 70.607 33.728 -2.367 1.00 0.00 H new ATOM 742 N HIS A 48 70.034 32.304 -4.254 1.00 0.00 N ATOM 743 CA HIS A 48 69.888 32.794 -5.620 1.00 0.00 C ATOM 744 C HIS A 48 69.419 31.679 -6.550 1.00 0.00 C ATOM 745 O HIS A 48 68.740 31.932 -7.546 1.00 0.00 O ATOM 746 CB HIS A 48 71.213 33.369 -6.122 1.00 0.00 C ATOM 747 CG HIS A 48 71.097 34.083 -7.434 1.00 0.00 C ATOM 748 ND1 HIS A 48 70.891 33.429 -8.631 1.00 0.00 N ATOM 749 CD2 HIS A 48 71.158 35.401 -7.733 1.00 0.00 C ATOM 750 CE1 HIS A 48 70.832 34.315 -9.609 1.00 0.00 C ATOM 751 NE2 HIS A 48 70.990 35.519 -9.091 1.00 0.00 N ATOM 0 H HIS A 48 70.999 32.239 -3.930 1.00 0.00 H new ATOM 0 HA HIS A 48 69.135 33.582 -5.619 1.00 0.00 H new ATOM 0 HB2 HIS A 48 71.606 34.059 -5.376 1.00 0.00 H new ATOM 0 HB3 HIS A 48 71.937 32.560 -6.221 1.00 0.00 H new ATOM 0 HD2 HIS A 48 71.310 36.210 -7.034 1.00 0.00 H new ATOM 0 HE1 HIS A 48 70.680 34.092 -10.655 1.00 0.00 H new ATOM 0 HE2 HIS A 48 70.988 36.395 -9.614 1.00 0.00 H new ATOM 759 N LEU A 49 69.785 30.446 -6.218 1.00 0.00 N ATOM 760 CA LEU A 49 69.403 29.291 -7.024 1.00 0.00 C ATOM 761 C LEU A 49 68.319 28.475 -6.326 1.00 0.00 C ATOM 762 O LEU A 49 67.851 27.467 -6.853 1.00 0.00 O ATOM 763 CB LEU A 49 70.622 28.411 -7.300 1.00 0.00 C ATOM 764 CG LEU A 49 71.894 29.142 -7.732 1.00 0.00 C ATOM 765 CD1 LEU A 49 73.125 28.312 -7.402 1.00 0.00 C ATOM 766 CD2 LEU A 49 71.847 29.461 -9.219 1.00 0.00 C ATOM 0 H LEU A 49 70.346 30.220 -5.396 1.00 0.00 H new ATOM 0 HA LEU A 49 69.005 29.655 -7.971 1.00 0.00 H new ATOM 0 HB2 LEU A 49 70.844 27.839 -6.399 1.00 0.00 H new ATOM 0 HB3 LEU A 49 70.358 27.693 -8.076 1.00 0.00 H new ATOM 0 HG LEU A 49 71.955 30.081 -7.181 1.00 0.00 H new ATOM 0 HD11 LEU A 49 74.020 28.848 -7.717 1.00 0.00 H new ATOM 0 HD12 LEU A 49 73.167 28.135 -6.327 1.00 0.00 H new ATOM 0 HD13 LEU A 49 73.071 27.357 -7.925 1.00 0.00 H new ATOM 0 HD21 LEU A 49 72.760 29.981 -9.509 1.00 0.00 H new ATOM 0 HD22 LEU A 49 71.761 28.535 -9.787 1.00 0.00 H new ATOM 0 HD23 LEU A 49 70.986 30.096 -9.428 1.00 0.00 H new ATOM 778 N GLY A 50 67.924 28.920 -5.137 1.00 0.00 N ATOM 779 CA GLY A 50 66.898 28.220 -4.387 1.00 0.00 C ATOM 780 C GLY A 50 67.205 26.745 -4.221 1.00 0.00 C ATOM 781 O GLY A 50 68.103 26.371 -3.466 1.00 0.00 O ATOM 0 H GLY A 50 68.296 29.753 -4.680 1.00 0.00 H new ATOM 0 HA2 GLY A 50 66.794 28.679 -3.404 1.00 0.00 H new ATOM 0 HA3 GLY A 50 65.940 28.334 -4.895 1.00 0.00 H new ATOM 785 N THR A 51 66.456 25.903 -4.927 1.00 0.00 N ATOM 786 CA THR A 51 66.651 24.460 -4.852 1.00 0.00 C ATOM 787 C THR A 51 67.426 23.947 -6.060 1.00 0.00 C ATOM 788 O THR A 51 67.024 22.978 -6.702 1.00 0.00 O ATOM 789 CB THR A 51 65.305 23.716 -4.765 1.00 0.00 C ATOM 790 OG1 THR A 51 64.334 24.534 -4.104 1.00 0.00 O ATOM 791 CG2 THR A 51 65.462 22.400 -4.017 1.00 0.00 C ATOM 0 H THR A 51 65.709 26.196 -5.557 1.00 0.00 H new ATOM 0 HA THR A 51 67.225 24.264 -3.946 1.00 0.00 H new ATOM 0 HB THR A 51 64.967 23.501 -5.779 1.00 0.00 H new ATOM 0 HG1 THR A 51 63.481 24.054 -4.055 1.00 0.00 H new ATOM 0 HG21 THR A 51 64.499 21.892 -3.968 1.00 0.00 H new ATOM 0 HG22 THR A 51 66.179 21.768 -4.540 1.00 0.00 H new ATOM 0 HG23 THR A 51 65.820 22.596 -3.007 1.00 0.00 H new ATOM 799 N GLY A 52 68.542 24.603 -6.364 1.00 0.00 N ATOM 800 CA GLY A 52 69.357 24.197 -7.494 1.00 0.00 C ATOM 801 C GLY A 52 70.330 23.090 -7.140 1.00 0.00 C ATOM 802 O GLY A 52 69.949 22.091 -6.529 1.00 0.00 O ATOM 0 H GLY A 52 68.896 25.408 -5.848 1.00 0.00 H new ATOM 0 HA2 GLY A 52 68.709 23.861 -8.303 1.00 0.00 H new ATOM 0 HA3 GLY A 52 69.912 25.058 -7.866 1.00 0.00 H new ATOM 806 N ARG A 53 71.590 23.265 -7.525 1.00 0.00 N ATOM 807 CA ARG A 53 72.619 22.271 -7.247 1.00 0.00 C ATOM 808 C ARG A 53 73.707 22.853 -6.349 1.00 0.00 C ATOM 809 O ARG A 53 74.073 24.021 -6.477 1.00 0.00 O ATOM 810 CB ARG A 53 73.236 21.766 -8.552 1.00 0.00 C ATOM 811 CG ARG A 53 72.571 20.512 -9.095 1.00 0.00 C ATOM 812 CD ARG A 53 71.212 20.822 -9.704 1.00 0.00 C ATOM 813 NE ARG A 53 70.752 19.754 -10.587 1.00 0.00 N ATOM 814 CZ ARG A 53 70.288 18.588 -10.151 1.00 0.00 C ATOM 815 NH1 ARG A 53 70.224 18.341 -8.850 1.00 0.00 N ATOM 816 NH2 ARG A 53 69.888 17.666 -11.017 1.00 0.00 N ATOM 0 H ARG A 53 71.923 24.086 -8.030 1.00 0.00 H new ATOM 0 HA ARG A 53 72.151 21.435 -6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 53 73.173 22.554 -9.302 1.00 0.00 H new ATOM 0 HB3 ARG A 53 74.295 21.564 -8.389 1.00 0.00 H new ATOM 0 HG2 ARG A 53 73.213 20.055 -9.848 1.00 0.00 H new ATOM 0 HG3 ARG A 53 72.454 19.784 -8.292 1.00 0.00 H new ATOM 0 HD2 ARG A 53 70.484 20.973 -8.907 1.00 0.00 H new ATOM 0 HD3 ARG A 53 71.270 21.756 -10.264 1.00 0.00 H new ATOM 0 HE ARG A 53 70.789 19.912 -11.594 1.00 0.00 H new ATOM 0 HH11 ARG A 53 70.531 19.047 -8.181 1.00 0.00 H new ATOM 0 HH12 ARG A 53 69.867 17.445 -8.518 1.00 0.00 H new ATOM 0 HH21 ARG A 53 69.937 17.852 -12.019 1.00 0.00 H new ATOM 0 HH22 ARG A 53 69.532 16.771 -10.681 1.00 0.00 H new ATOM 830 N TRP A 54 74.219 22.030 -5.441 1.00 0.00 N ATOM 831 CA TRP A 54 75.265 22.463 -4.521 1.00 0.00 C ATOM 832 C TRP A 54 76.435 23.081 -5.278 1.00 0.00 C ATOM 833 O TRP A 54 77.056 24.034 -4.808 1.00 0.00 O ATOM 834 CB TRP A 54 75.753 21.282 -3.679 1.00 0.00 C ATOM 835 CG TRP A 54 75.826 19.996 -4.446 1.00 0.00 C ATOM 836 CD1 TRP A 54 76.718 19.679 -5.430 1.00 0.00 C ATOM 837 CD2 TRP A 54 74.973 18.857 -4.292 1.00 0.00 C ATOM 838 NE1 TRP A 54 76.471 18.411 -5.897 1.00 0.00 N ATOM 839 CE2 TRP A 54 75.406 17.885 -5.215 1.00 0.00 C ATOM 840 CE3 TRP A 54 73.887 18.563 -3.464 1.00 0.00 C ATOM 841 CZ2 TRP A 54 74.788 16.643 -5.331 1.00 0.00 C ATOM 842 CZ3 TRP A 54 73.275 17.329 -3.581 1.00 0.00 C ATOM 843 CH2 TRP A 54 73.727 16.381 -4.508 1.00 0.00 C ATOM 0 H TRP A 54 73.927 21.060 -5.322 1.00 0.00 H new ATOM 0 HA TRP A 54 74.843 23.221 -3.861 1.00 0.00 H new ATOM 0 HB2 TRP A 54 76.740 21.514 -3.278 1.00 0.00 H new ATOM 0 HB3 TRP A 54 75.085 21.152 -2.827 1.00 0.00 H new ATOM 0 HD1 TRP A 54 77.502 20.329 -5.788 1.00 0.00 H new ATOM 0 HE1 TRP A 54 76.996 17.938 -6.633 1.00 0.00 H new ATOM 0 HE3 TRP A 54 73.532 19.287 -2.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 75.134 15.911 -6.046 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 72.434 17.092 -2.947 1.00 0.00 H new ATOM 0 HH2 TRP A 54 73.228 15.425 -4.574 1.00 0.00 H new ATOM 854 N ARG A 55 76.730 22.533 -6.452 1.00 0.00 N ATOM 855 CA ARG A 55 77.826 23.031 -7.274 1.00 0.00 C ATOM 856 C ARG A 55 77.491 24.401 -7.856 1.00 0.00 C ATOM 857 O ARG A 55 78.382 25.208 -8.122 1.00 0.00 O ATOM 858 CB ARG A 55 78.132 22.047 -8.404 1.00 0.00 C ATOM 859 CG ARG A 55 77.096 22.054 -9.516 1.00 0.00 C ATOM 860 CD ARG A 55 77.318 20.909 -10.492 1.00 0.00 C ATOM 861 NE ARG A 55 76.734 19.660 -10.011 1.00 0.00 N ATOM 862 CZ ARG A 55 77.062 18.464 -10.488 1.00 0.00 C ATOM 863 NH1 ARG A 55 77.965 18.357 -11.454 1.00 0.00 N ATOM 864 NH2 ARG A 55 76.488 17.373 -9.999 1.00 0.00 N ATOM 0 H ARG A 55 76.225 21.744 -6.855 1.00 0.00 H new ATOM 0 HA ARG A 55 78.706 23.130 -6.639 1.00 0.00 H new ATOM 0 HB2 ARG A 55 79.108 22.285 -8.827 1.00 0.00 H new ATOM 0 HB3 ARG A 55 78.201 21.041 -7.990 1.00 0.00 H new ATOM 0 HG2 ARG A 55 76.098 21.978 -9.085 1.00 0.00 H new ATOM 0 HG3 ARG A 55 77.141 23.003 -10.050 1.00 0.00 H new ATOM 0 HD2 ARG A 55 76.881 21.165 -11.457 1.00 0.00 H new ATOM 0 HD3 ARG A 55 78.387 20.771 -10.652 1.00 0.00 H new ATOM 0 HE ARG A 55 76.036 19.708 -9.268 1.00 0.00 H new ATOM 0 HH11 ARG A 55 78.409 19.194 -11.832 1.00 0.00 H new ATOM 0 HH12 ARG A 55 78.215 17.438 -11.819 1.00 0.00 H new ATOM 0 HH21 ARG A 55 75.794 17.451 -9.256 1.00 0.00 H new ATOM 0 HH22 ARG A 55 76.741 16.456 -10.366 1.00 0.00 H new ATOM 878 N ASP A 56 76.202 24.656 -8.050 1.00 0.00 N ATOM 879 CA ASP A 56 75.748 25.929 -8.599 1.00 0.00 C ATOM 880 C ASP A 56 75.934 27.055 -7.586 1.00 0.00 C ATOM 881 O ASP A 56 76.342 28.161 -7.940 1.00 0.00 O ATOM 882 CB ASP A 56 74.279 25.836 -9.013 1.00 0.00 C ATOM 883 CG ASP A 56 74.040 24.767 -10.062 1.00 0.00 C ATOM 884 OD1 ASP A 56 75.023 24.130 -10.495 1.00 0.00 O ATOM 885 OD2 ASP A 56 72.870 24.567 -10.448 1.00 0.00 O ATOM 0 H ASP A 56 75.453 23.998 -7.835 1.00 0.00 H new ATOM 0 HA ASP A 56 76.351 26.153 -9.479 1.00 0.00 H new ATOM 0 HB2 ASP A 56 73.670 25.622 -8.135 1.00 0.00 H new ATOM 0 HB3 ASP A 56 73.952 26.801 -9.400 1.00 0.00 H new ATOM 890 N VAL A 57 75.629 26.766 -6.325 1.00 0.00 N ATOM 891 CA VAL A 57 75.762 27.753 -5.261 1.00 0.00 C ATOM 892 C VAL A 57 77.227 27.991 -4.911 1.00 0.00 C ATOM 893 O VAL A 57 77.602 29.075 -4.464 1.00 0.00 O ATOM 894 CB VAL A 57 75.007 27.316 -3.992 1.00 0.00 C ATOM 895 CG1 VAL A 57 73.766 26.515 -4.358 1.00 0.00 C ATOM 896 CG2 VAL A 57 75.921 26.512 -3.079 1.00 0.00 C ATOM 0 H VAL A 57 75.288 25.856 -6.016 1.00 0.00 H new ATOM 0 HA VAL A 57 75.325 28.680 -5.633 1.00 0.00 H new ATOM 0 HB VAL A 57 74.688 28.209 -3.454 1.00 0.00 H new ATOM 0 HG11 VAL A 57 73.245 26.215 -3.449 1.00 0.00 H new ATOM 0 HG12 VAL A 57 73.104 27.128 -4.969 1.00 0.00 H new ATOM 0 HG13 VAL A 57 74.058 25.627 -4.919 1.00 0.00 H new ATOM 0 HG21 VAL A 57 75.371 26.211 -2.187 1.00 0.00 H new ATOM 0 HG22 VAL A 57 76.272 25.624 -3.605 1.00 0.00 H new ATOM 0 HG23 VAL A 57 76.776 27.124 -2.789 1.00 0.00 H new ATOM 906 N LYS A 58 78.052 26.970 -5.118 1.00 0.00 N ATOM 907 CA LYS A 58 79.477 27.067 -4.827 1.00 0.00 C ATOM 908 C LYS A 58 80.181 27.959 -5.845 1.00 0.00 C ATOM 909 O LYS A 58 80.963 28.837 -5.479 1.00 0.00 O ATOM 910 CB LYS A 58 80.114 25.675 -4.826 1.00 0.00 C ATOM 911 CG LYS A 58 81.607 25.690 -4.551 1.00 0.00 C ATOM 912 CD LYS A 58 82.410 25.793 -5.837 1.00 0.00 C ATOM 913 CE LYS A 58 83.864 25.404 -5.619 1.00 0.00 C ATOM 914 NZ LYS A 58 84.572 26.372 -4.736 1.00 0.00 N ATOM 0 H LYS A 58 77.758 26.066 -5.486 1.00 0.00 H new ATOM 0 HA LYS A 58 79.591 27.513 -3.839 1.00 0.00 H new ATOM 0 HB2 LYS A 58 79.621 25.059 -4.074 1.00 0.00 H new ATOM 0 HB3 LYS A 58 79.936 25.202 -5.792 1.00 0.00 H new ATOM 0 HG2 LYS A 58 81.850 26.531 -3.901 1.00 0.00 H new ATOM 0 HG3 LYS A 58 81.889 24.783 -4.017 1.00 0.00 H new ATOM 0 HD2 LYS A 58 81.969 25.146 -6.595 1.00 0.00 H new ATOM 0 HD3 LYS A 58 82.358 26.813 -6.219 1.00 0.00 H new ATOM 0 HE2 LYS A 58 83.911 24.409 -5.178 1.00 0.00 H new ATOM 0 HE3 LYS A 58 84.374 25.350 -6.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 85.308 26.865 -5.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 83.892 27.066 -4.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 85.011 25.862 -3.943 1.00 0.00 H new ATOM 928 N PHE A 59 79.898 27.729 -7.123 1.00 0.00 N ATOM 929 CA PHE A 59 80.504 28.512 -8.193 1.00 0.00 C ATOM 930 C PHE A 59 79.904 29.914 -8.247 1.00 0.00 C ATOM 931 O PHE A 59 80.624 30.905 -8.373 1.00 0.00 O ATOM 932 CB PHE A 59 80.311 27.811 -9.539 1.00 0.00 C ATOM 933 CG PHE A 59 80.930 28.547 -10.693 1.00 0.00 C ATOM 934 CD1 PHE A 59 82.282 28.419 -10.968 1.00 0.00 C ATOM 935 CD2 PHE A 59 80.159 29.367 -11.502 1.00 0.00 C ATOM 936 CE1 PHE A 59 82.853 29.097 -12.029 1.00 0.00 C ATOM 937 CE2 PHE A 59 80.725 30.046 -12.564 1.00 0.00 C ATOM 938 CZ PHE A 59 82.074 29.910 -12.828 1.00 0.00 C ATOM 0 H PHE A 59 79.253 27.007 -7.443 1.00 0.00 H new ATOM 0 HA PHE A 59 81.571 28.599 -7.986 1.00 0.00 H new ATOM 0 HB2 PHE A 59 80.741 26.811 -9.484 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.244 27.689 -9.726 1.00 0.00 H new ATOM 0 HD1 PHE A 59 82.896 27.783 -10.347 1.00 0.00 H new ATOM 0 HD2 PHE A 59 79.104 29.476 -11.300 1.00 0.00 H new ATOM 0 HE1 PHE A 59 83.908 28.991 -12.233 1.00 0.00 H new ATOM 0 HE2 PHE A 59 80.114 30.682 -13.187 1.00 0.00 H new ATOM 0 HZ PHE A 59 82.519 30.439 -13.658 1.00 0.00 H new ATOM 948 N ARG A 60 78.580 29.989 -8.152 1.00 0.00 N ATOM 949 CA ARG A 60 77.883 31.269 -8.192 1.00 0.00 C ATOM 950 C ARG A 60 78.375 32.191 -7.081 1.00 0.00 C ATOM 951 O ARG A 60 78.484 33.403 -7.269 1.00 0.00 O ATOM 952 CB ARG A 60 76.373 31.055 -8.061 1.00 0.00 C ATOM 953 CG ARG A 60 75.573 32.347 -8.066 1.00 0.00 C ATOM 954 CD ARG A 60 74.233 32.169 -8.762 1.00 0.00 C ATOM 955 NE ARG A 60 73.947 33.262 -9.687 1.00 0.00 N ATOM 956 CZ ARG A 60 74.444 33.334 -10.917 1.00 0.00 C ATOM 957 NH1 ARG A 60 75.248 32.380 -11.367 1.00 0.00 N ATOM 958 NH2 ARG A 60 74.138 34.361 -11.699 1.00 0.00 N ATOM 0 H ARG A 60 77.969 29.179 -8.047 1.00 0.00 H new ATOM 0 HA ARG A 60 78.095 31.740 -9.152 1.00 0.00 H new ATOM 0 HB2 ARG A 60 76.032 30.423 -8.881 1.00 0.00 H new ATOM 0 HB3 ARG A 60 76.170 30.515 -7.136 1.00 0.00 H new ATOM 0 HG2 ARG A 60 75.410 32.680 -7.041 1.00 0.00 H new ATOM 0 HG3 ARG A 60 76.144 33.128 -8.568 1.00 0.00 H new ATOM 0 HD2 ARG A 60 74.230 31.224 -9.305 1.00 0.00 H new ATOM 0 HD3 ARG A 60 73.442 32.110 -8.015 1.00 0.00 H new ATOM 0 HE ARG A 60 73.332 34.012 -9.371 1.00 0.00 H new ATOM 0 HH11 ARG A 60 75.486 31.589 -10.768 1.00 0.00 H new ATOM 0 HH12 ARG A 60 75.628 32.437 -12.312 1.00 0.00 H new ATOM 0 HH21 ARG A 60 73.520 35.097 -11.356 1.00 0.00 H new ATOM 0 HH22 ARG A 60 74.520 34.415 -12.643 1.00 0.00 H new ATOM 972 N ALA A 61 78.670 31.610 -5.923 1.00 0.00 N ATOM 973 CA ALA A 61 79.152 32.379 -4.783 1.00 0.00 C ATOM 974 C ALA A 61 80.459 33.091 -5.113 1.00 0.00 C ATOM 975 O ALA A 61 80.504 34.318 -5.205 1.00 0.00 O ATOM 976 CB ALA A 61 79.333 31.474 -3.573 1.00 0.00 C ATOM 0 H ALA A 61 78.583 30.609 -5.750 1.00 0.00 H new ATOM 0 HA ALA A 61 78.405 33.137 -4.547 1.00 0.00 H new ATOM 0 HB1 ALA A 61 79.693 32.062 -2.729 1.00 0.00 H new ATOM 0 HB2 ALA A 61 78.378 31.016 -3.315 1.00 0.00 H new ATOM 0 HB3 ALA A 61 80.057 30.694 -3.807 1.00 0.00 H new ATOM 982 N PHE A 62 81.522 32.313 -5.290 1.00 0.00 N ATOM 983 CA PHE A 62 82.832 32.869 -5.609 1.00 0.00 C ATOM 984 C PHE A 62 83.832 31.760 -5.925 1.00 0.00 C ATOM 985 O PHE A 62 84.439 31.184 -5.024 1.00 0.00 O ATOM 986 CB PHE A 62 83.346 33.718 -4.445 1.00 0.00 C ATOM 987 CG PHE A 62 83.281 35.196 -4.706 1.00 0.00 C ATOM 988 CD1 PHE A 62 84.003 35.762 -5.745 1.00 0.00 C ATOM 989 CD2 PHE A 62 82.498 36.019 -3.913 1.00 0.00 C ATOM 990 CE1 PHE A 62 83.945 37.121 -5.986 1.00 0.00 C ATOM 991 CE2 PHE A 62 82.437 37.379 -4.150 1.00 0.00 C ATOM 992 CZ PHE A 62 83.160 37.931 -5.189 1.00 0.00 C ATOM 0 H PHE A 62 81.502 31.296 -5.218 1.00 0.00 H new ATOM 0 HA PHE A 62 82.726 33.500 -6.491 1.00 0.00 H new ATOM 0 HB2 PHE A 62 82.763 33.489 -3.553 1.00 0.00 H new ATOM 0 HB3 PHE A 62 84.378 33.440 -4.231 1.00 0.00 H new ATOM 0 HD1 PHE A 62 84.617 35.134 -6.373 1.00 0.00 H new ATOM 0 HD2 PHE A 62 81.929 35.593 -3.100 1.00 0.00 H new ATOM 0 HE1 PHE A 62 84.514 37.550 -6.798 1.00 0.00 H new ATOM 0 HE2 PHE A 62 81.824 38.010 -3.523 1.00 0.00 H new ATOM 0 HZ PHE A 62 83.112 38.993 -5.378 1.00 0.00 H new ATOM 1002 N GLU A 63 83.995 31.468 -7.212 1.00 0.00 N ATOM 1003 CA GLU A 63 84.919 30.428 -7.647 1.00 0.00 C ATOM 1004 C GLU A 63 86.346 30.750 -7.210 1.00 0.00 C ATOM 1005 O GLU A 63 87.194 29.863 -7.121 1.00 0.00 O ATOM 1006 CB GLU A 63 84.864 30.269 -9.168 1.00 0.00 C ATOM 1007 CG GLU A 63 85.924 29.331 -9.721 1.00 0.00 C ATOM 1008 CD GLU A 63 87.081 30.072 -10.363 1.00 0.00 C ATOM 1009 OE1 GLU A 63 86.824 31.053 -11.093 1.00 0.00 O ATOM 1010 OE2 GLU A 63 88.242 29.673 -10.137 1.00 0.00 O ATOM 0 H GLU A 63 83.500 31.937 -7.970 1.00 0.00 H new ATOM 0 HA GLU A 63 84.617 29.491 -7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 63 83.879 29.897 -9.451 1.00 0.00 H new ATOM 0 HB3 GLU A 63 84.980 31.249 -9.632 1.00 0.00 H new ATOM 0 HG2 GLU A 63 86.303 28.702 -8.916 1.00 0.00 H new ATOM 0 HG3 GLU A 63 85.469 28.668 -10.457 1.00 0.00 H new ATOM 1017 N ASN A 64 86.601 32.025 -6.939 1.00 0.00 N ATOM 1018 CA ASN A 64 87.925 32.466 -6.512 1.00 0.00 C ATOM 1019 C ASN A 64 88.287 31.866 -5.157 1.00 0.00 C ATOM 1020 O ASN A 64 89.463 31.711 -4.829 1.00 0.00 O ATOM 1021 CB ASN A 64 87.977 33.993 -6.437 1.00 0.00 C ATOM 1022 CG ASN A 64 89.389 34.514 -6.248 1.00 0.00 C ATOM 1023 OD1 ASN A 64 90.148 34.645 -7.208 1.00 0.00 O ATOM 1024 ND2 ASN A 64 89.746 34.815 -5.005 1.00 0.00 N ATOM 0 H ASN A 64 85.909 32.772 -7.007 1.00 0.00 H new ATOM 0 HA ASN A 64 88.651 32.120 -7.248 1.00 0.00 H new ATOM 0 HB2 ASN A 64 87.556 34.414 -7.350 1.00 0.00 H new ATOM 0 HB3 ASN A 64 87.353 34.335 -5.612 1.00 0.00 H new ATOM 0 HD21 ASN A 64 90.683 35.171 -4.815 1.00 0.00 H new ATOM 0 HD22 ASN A 64 89.083 34.690 -4.240 1.00 0.00 H new ATOM 1031 N VAL A 65 87.267 31.529 -4.374 1.00 0.00 N ATOM 1032 CA VAL A 65 87.477 30.944 -3.055 1.00 0.00 C ATOM 1033 C VAL A 65 88.165 29.587 -3.158 1.00 0.00 C ATOM 1034 O VAL A 65 89.289 29.411 -2.687 1.00 0.00 O ATOM 1035 CB VAL A 65 86.147 30.777 -2.297 1.00 0.00 C ATOM 1036 CG1 VAL A 65 86.397 30.275 -0.883 1.00 0.00 C ATOM 1037 CG2 VAL A 65 85.377 32.088 -2.277 1.00 0.00 C ATOM 0 H VAL A 65 86.287 31.651 -4.630 1.00 0.00 H new ATOM 0 HA VAL A 65 88.118 31.631 -2.503 1.00 0.00 H new ATOM 0 HB VAL A 65 85.543 30.035 -2.819 1.00 0.00 H new ATOM 0 HG11 VAL A 65 85.446 30.163 -0.363 1.00 0.00 H new ATOM 0 HG12 VAL A 65 86.904 29.311 -0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 65 87.021 30.991 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 65 84.440 31.951 -1.737 1.00 0.00 H new ATOM 0 HG22 VAL A 65 85.974 32.853 -1.780 1.00 0.00 H new ATOM 0 HG23 VAL A 65 85.165 32.401 -3.299 1.00 0.00 H new ATOM 1047 N HIS A 66 87.483 28.630 -3.779 1.00 0.00 N ATOM 1048 CA HIS A 66 88.029 27.288 -3.945 1.00 0.00 C ATOM 1049 C HIS A 66 88.464 26.708 -2.603 1.00 0.00 C ATOM 1050 O HIS A 66 89.372 25.879 -2.539 1.00 0.00 O ATOM 1051 CB HIS A 66 89.213 27.312 -4.912 1.00 0.00 C ATOM 1052 CG HIS A 66 89.527 25.975 -5.509 1.00 0.00 C ATOM 1053 ND1 HIS A 66 88.664 25.304 -6.349 1.00 0.00 N ATOM 1054 CD2 HIS A 66 90.618 25.184 -5.383 1.00 0.00 C ATOM 1055 CE1 HIS A 66 89.210 24.158 -6.714 1.00 0.00 C ATOM 1056 NE2 HIS A 66 90.396 24.061 -6.142 1.00 0.00 N ATOM 0 H HIS A 66 86.552 28.759 -4.175 1.00 0.00 H new ATOM 0 HA HIS A 66 87.246 26.653 -4.358 1.00 0.00 H new ATOM 0 HB2 HIS A 66 89.001 28.018 -5.715 1.00 0.00 H new ATOM 0 HB3 HIS A 66 90.093 27.682 -4.386 1.00 0.00 H new ATOM 0 HD2 HIS A 66 91.499 25.396 -4.795 1.00 0.00 H new ATOM 0 HE1 HIS A 66 88.762 23.425 -7.369 1.00 0.00 H new ATOM 0 HE2 HIS A 66 91.042 23.279 -6.247 1.00 0.00 H new ATOM 1064 N HIS A 67 87.811 27.150 -1.533 1.00 0.00 N ATOM 1065 CA HIS A 67 88.131 26.674 -0.192 1.00 0.00 C ATOM 1066 C HIS A 67 86.882 26.150 0.511 1.00 0.00 C ATOM 1067 O HIS A 67 86.712 26.336 1.716 1.00 0.00 O ATOM 1068 CB HIS A 67 88.761 27.797 0.633 1.00 0.00 C ATOM 1069 CG HIS A 67 89.670 27.306 1.718 1.00 0.00 C ATOM 1070 ND1 HIS A 67 91.022 27.108 1.534 1.00 0.00 N ATOM 1071 CD2 HIS A 67 89.414 26.975 3.005 1.00 0.00 C ATOM 1072 CE1 HIS A 67 91.558 26.674 2.660 1.00 0.00 C ATOM 1073 NE2 HIS A 67 90.604 26.585 3.569 1.00 0.00 N ATOM 0 H HIS A 67 87.058 27.837 -1.568 1.00 0.00 H new ATOM 0 HA HIS A 67 88.845 25.856 -0.284 1.00 0.00 H new ATOM 0 HB2 HIS A 67 89.323 28.453 -0.031 1.00 0.00 H new ATOM 0 HB3 HIS A 67 87.968 28.398 1.079 1.00 0.00 H new ATOM 0 HD2 HIS A 67 88.453 27.011 3.497 1.00 0.00 H new ATOM 0 HE1 HIS A 67 92.600 26.433 2.812 1.00 0.00 H new ATOM 0 HE2 HIS A 67 90.730 26.277 4.533 1.00 0.00 H new ATOM 1081 N ARG A 68 86.013 25.493 -0.250 1.00 0.00 N ATOM 1082 CA ARG A 68 84.779 24.944 0.300 1.00 0.00 C ATOM 1083 C ARG A 68 84.193 23.886 -0.631 1.00 0.00 C ATOM 1084 O ARG A 68 84.405 23.924 -1.844 1.00 0.00 O ATOM 1085 CB ARG A 68 83.757 26.058 0.531 1.00 0.00 C ATOM 1086 CG ARG A 68 82.719 25.723 1.589 1.00 0.00 C ATOM 1087 CD ARG A 68 83.327 25.716 2.983 1.00 0.00 C ATOM 1088 NE ARG A 68 83.957 26.992 3.312 1.00 0.00 N ATOM 1089 CZ ARG A 68 84.862 27.138 4.274 1.00 0.00 C ATOM 1090 NH1 ARG A 68 85.240 26.094 4.998 1.00 0.00 N ATOM 1091 NH2 ARG A 68 85.390 28.332 4.513 1.00 0.00 N ATOM 0 H ARG A 68 86.140 25.328 -1.248 1.00 0.00 H new ATOM 0 HA ARG A 68 85.014 24.474 1.255 1.00 0.00 H new ATOM 0 HB2 ARG A 68 84.283 26.966 0.825 1.00 0.00 H new ATOM 0 HB3 ARG A 68 83.249 26.274 -0.409 1.00 0.00 H new ATOM 0 HG2 ARG A 68 81.908 26.450 1.548 1.00 0.00 H new ATOM 0 HG3 ARG A 68 82.283 24.747 1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 68 82.551 25.495 3.716 1.00 0.00 H new ATOM 0 HD3 ARG A 68 84.067 24.918 3.052 1.00 0.00 H new ATOM 0 HE ARG A 68 83.688 27.816 2.774 1.00 0.00 H new ATOM 0 HH11 ARG A 68 84.836 25.175 4.817 1.00 0.00 H new ATOM 0 HH12 ARG A 68 85.935 26.210 5.736 1.00 0.00 H new ATOM 0 HH21 ARG A 68 85.101 29.138 3.958 1.00 0.00 H new ATOM 0 HH22 ARG A 68 86.085 28.444 5.251 1.00 0.00 H new ATOM 1105 N THR A 69 83.454 22.942 -0.056 1.00 0.00 N ATOM 1106 CA THR A 69 82.839 21.874 -0.833 1.00 0.00 C ATOM 1107 C THR A 69 81.386 22.198 -1.159 1.00 0.00 C ATOM 1108 O THR A 69 80.698 22.860 -0.382 1.00 0.00 O ATOM 1109 CB THR A 69 82.897 20.529 -0.084 1.00 0.00 C ATOM 1110 OG1 THR A 69 84.100 20.452 0.690 1.00 0.00 O ATOM 1111 CG2 THR A 69 82.840 19.363 -1.060 1.00 0.00 C ATOM 0 H THR A 69 83.267 22.896 0.946 1.00 0.00 H new ATOM 0 HA THR A 69 83.407 21.790 -1.760 1.00 0.00 H new ATOM 0 HB THR A 69 82.034 20.469 0.579 1.00 0.00 H new ATOM 0 HG1 THR A 69 84.129 19.595 1.165 1.00 0.00 H new ATOM 0 HG21 THR A 69 82.882 18.424 -0.508 1.00 0.00 H new ATOM 0 HG22 THR A 69 81.910 19.409 -1.627 1.00 0.00 H new ATOM 0 HG23 THR A 69 83.686 19.420 -1.745 1.00 0.00 H new ATOM 1119 N TYR A 70 80.924 21.727 -2.312 1.00 0.00 N ATOM 1120 CA TYR A 70 79.552 21.969 -2.742 1.00 0.00 C ATOM 1121 C TYR A 70 78.564 21.625 -1.631 1.00 0.00 C ATOM 1122 O TYR A 70 77.807 22.479 -1.171 1.00 0.00 O ATOM 1123 CB TYR A 70 79.235 21.148 -3.993 1.00 0.00 C ATOM 1124 CG TYR A 70 80.340 21.167 -5.025 1.00 0.00 C ATOM 1125 CD1 TYR A 70 81.069 22.324 -5.271 1.00 0.00 C ATOM 1126 CD2 TYR A 70 80.656 20.026 -5.753 1.00 0.00 C ATOM 1127 CE1 TYR A 70 82.079 22.345 -6.214 1.00 0.00 C ATOM 1128 CE2 TYR A 70 81.666 20.038 -6.696 1.00 0.00 C ATOM 1129 CZ TYR A 70 82.374 21.199 -6.923 1.00 0.00 C ATOM 1130 OH TYR A 70 83.380 21.216 -7.862 1.00 0.00 O ATOM 0 H TYR A 70 81.480 21.175 -2.966 1.00 0.00 H new ATOM 0 HA TYR A 70 79.453 23.029 -2.976 1.00 0.00 H new ATOM 0 HB2 TYR A 70 79.040 20.116 -3.701 1.00 0.00 H new ATOM 0 HB3 TYR A 70 78.320 21.530 -4.446 1.00 0.00 H new ATOM 0 HD1 TYR A 70 80.842 23.222 -4.716 1.00 0.00 H new ATOM 0 HD2 TYR A 70 80.103 19.115 -5.579 1.00 0.00 H new ATOM 0 HE1 TYR A 70 82.634 23.254 -6.395 1.00 0.00 H new ATOM 0 HE2 TYR A 70 81.900 19.142 -7.252 1.00 0.00 H new ATOM 0 HH TYR A 70 83.461 20.329 -8.271 1.00 0.00 H new ATOM 1140 N VAL A 71 78.580 20.366 -1.204 1.00 0.00 N ATOM 1141 CA VAL A 71 77.688 19.907 -0.146 1.00 0.00 C ATOM 1142 C VAL A 71 77.822 20.774 1.101 1.00 0.00 C ATOM 1143 O VAL A 71 76.851 20.992 1.826 1.00 0.00 O ATOM 1144 CB VAL A 71 77.971 18.440 0.229 1.00 0.00 C ATOM 1145 CG1 VAL A 71 79.413 18.273 0.682 1.00 0.00 C ATOM 1146 CG2 VAL A 71 77.006 17.971 1.309 1.00 0.00 C ATOM 0 H VAL A 71 79.201 19.646 -1.574 1.00 0.00 H new ATOM 0 HA VAL A 71 76.672 19.986 -0.532 1.00 0.00 H new ATOM 0 HB VAL A 71 77.820 17.821 -0.655 1.00 0.00 H new ATOM 0 HG11 VAL A 71 79.594 17.230 0.943 1.00 0.00 H new ATOM 0 HG12 VAL A 71 80.084 18.567 -0.125 1.00 0.00 H new ATOM 0 HG13 VAL A 71 79.596 18.902 1.553 1.00 0.00 H new ATOM 0 HG21 VAL A 71 77.220 16.933 1.562 1.00 0.00 H new ATOM 0 HG22 VAL A 71 77.124 18.592 2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 71 75.983 18.052 0.943 1.00 0.00 H new ATOM 1156 N ASP A 72 79.032 21.266 1.345 1.00 0.00 N ATOM 1157 CA ASP A 72 79.294 22.111 2.504 1.00 0.00 C ATOM 1158 C ASP A 72 78.449 23.380 2.453 1.00 0.00 C ATOM 1159 O ASP A 72 77.885 23.804 3.463 1.00 0.00 O ATOM 1160 CB ASP A 72 80.778 22.474 2.571 1.00 0.00 C ATOM 1161 CG ASP A 72 81.357 22.288 3.960 1.00 0.00 C ATOM 1162 OD1 ASP A 72 81.590 21.127 4.355 1.00 0.00 O ATOM 1163 OD2 ASP A 72 81.578 23.304 4.652 1.00 0.00 O ATOM 0 H ASP A 72 79.847 21.094 0.756 1.00 0.00 H new ATOM 0 HA ASP A 72 79.024 21.552 3.400 1.00 0.00 H new ATOM 0 HB2 ASP A 72 81.332 21.857 1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 72 80.910 23.511 2.261 1.00 0.00 H new ATOM 1168 N LEU A 73 78.367 23.983 1.273 1.00 0.00 N ATOM 1169 CA LEU A 73 77.591 25.205 1.090 1.00 0.00 C ATOM 1170 C LEU A 73 76.105 24.945 1.314 1.00 0.00 C ATOM 1171 O LEU A 73 75.471 25.586 2.153 1.00 0.00 O ATOM 1172 CB LEU A 73 77.816 25.770 -0.314 1.00 0.00 C ATOM 1173 CG LEU A 73 79.180 26.413 -0.568 1.00 0.00 C ATOM 1174 CD1 LEU A 73 80.063 25.485 -1.388 1.00 0.00 C ATOM 1175 CD2 LEU A 73 79.016 27.753 -1.270 1.00 0.00 C ATOM 0 H LEU A 73 78.828 23.646 0.428 1.00 0.00 H new ATOM 0 HA LEU A 73 77.928 25.934 1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 73 77.677 24.964 -1.035 1.00 0.00 H new ATOM 0 HB3 LEU A 73 77.044 26.513 -0.513 1.00 0.00 H new ATOM 0 HG LEU A 73 79.663 26.586 0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 73 81.029 25.959 -1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 73 80.208 24.550 -0.848 1.00 0.00 H new ATOM 0 HD13 LEU A 73 79.585 25.280 -2.346 1.00 0.00 H new ATOM 0 HD21 LEU A 73 79.997 28.196 -1.443 1.00 0.00 H new ATOM 0 HD22 LEU A 73 78.512 27.604 -2.225 1.00 0.00 H new ATOM 0 HD23 LEU A 73 78.421 28.420 -0.646 1.00 0.00 H new ATOM 1187 N LYS A 74 75.555 24.000 0.560 1.00 0.00 N ATOM 1188 CA LYS A 74 74.144 23.651 0.678 1.00 0.00 C ATOM 1189 C LYS A 74 73.807 23.219 2.101 1.00 0.00 C ATOM 1190 O LYS A 74 72.812 23.662 2.675 1.00 0.00 O ATOM 1191 CB LYS A 74 73.790 22.531 -0.304 1.00 0.00 C ATOM 1192 CG LYS A 74 72.303 22.423 -0.594 1.00 0.00 C ATOM 1193 CD LYS A 74 71.616 21.469 0.368 1.00 0.00 C ATOM 1194 CE LYS A 74 71.758 20.024 -0.084 1.00 0.00 C ATOM 1195 NZ LYS A 74 70.641 19.174 0.412 1.00 0.00 N ATOM 0 H LYS A 74 76.065 23.461 -0.140 1.00 0.00 H new ATOM 0 HA LYS A 74 73.556 24.536 0.437 1.00 0.00 H new ATOM 0 HB2 LYS A 74 74.323 22.698 -1.240 1.00 0.00 H new ATOM 0 HB3 LYS A 74 74.143 21.581 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 74 71.844 23.409 -0.520 1.00 0.00 H new ATOM 0 HG3 LYS A 74 72.155 22.079 -1.617 1.00 0.00 H new ATOM 0 HD2 LYS A 74 72.044 21.584 1.364 1.00 0.00 H new ATOM 0 HD3 LYS A 74 70.559 21.725 0.444 1.00 0.00 H new ATOM 0 HE2 LYS A 74 71.787 19.986 -1.173 1.00 0.00 H new ATOM 0 HE3 LYS A 74 72.706 19.623 0.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 70.775 18.197 0.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 70.628 19.190 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 69.738 19.541 0.049 1.00 0.00 H new ATOM 1209 N ASP A 75 74.642 22.353 2.665 1.00 0.00 N ATOM 1210 CA ASP A 75 74.434 21.863 4.023 1.00 0.00 C ATOM 1211 C ASP A 75 74.552 22.999 5.034 1.00 0.00 C ATOM 1212 O ASP A 75 73.812 23.050 6.016 1.00 0.00 O ATOM 1213 CB ASP A 75 75.445 20.764 4.351 1.00 0.00 C ATOM 1214 CG ASP A 75 75.016 19.918 5.534 1.00 0.00 C ATOM 1215 OD1 ASP A 75 74.185 19.005 5.341 1.00 0.00 O ATOM 1216 OD2 ASP A 75 75.512 20.167 6.652 1.00 0.00 O ATOM 0 H ASP A 75 75.469 21.976 2.203 1.00 0.00 H new ATOM 0 HA ASP A 75 73.427 21.450 4.084 1.00 0.00 H new ATOM 0 HB2 ASP A 75 75.577 20.124 3.479 1.00 0.00 H new ATOM 0 HB3 ASP A 75 76.413 21.217 4.564 1.00 0.00 H new ATOM 1221 N LYS A 76 75.489 23.908 4.788 1.00 0.00 N ATOM 1222 CA LYS A 76 75.706 25.044 5.676 1.00 0.00 C ATOM 1223 C LYS A 76 74.445 25.896 5.788 1.00 0.00 C ATOM 1224 O LYS A 76 74.064 26.316 6.881 1.00 0.00 O ATOM 1225 CB LYS A 76 76.868 25.900 5.169 1.00 0.00 C ATOM 1226 CG LYS A 76 78.211 25.521 5.771 1.00 0.00 C ATOM 1227 CD LYS A 76 78.402 26.143 7.144 1.00 0.00 C ATOM 1228 CE LYS A 76 79.859 26.099 7.578 1.00 0.00 C ATOM 1229 NZ LYS A 76 79.996 25.831 9.036 1.00 0.00 N ATOM 0 H LYS A 76 76.111 23.880 3.980 1.00 0.00 H new ATOM 0 HA LYS A 76 75.952 24.657 6.665 1.00 0.00 H new ATOM 0 HB2 LYS A 76 76.927 25.811 4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 76 76.662 26.947 5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 76 78.283 24.436 5.849 1.00 0.00 H new ATOM 0 HG3 LYS A 76 79.013 25.847 5.108 1.00 0.00 H new ATOM 0 HD2 LYS A 76 78.057 27.177 7.127 1.00 0.00 H new ATOM 0 HD3 LYS A 76 77.788 25.614 7.873 1.00 0.00 H new ATOM 0 HE2 LYS A 76 80.382 25.325 7.016 1.00 0.00 H new ATOM 0 HE3 LYS A 76 80.339 27.048 7.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 80.771 26.406 9.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 79.108 26.076 9.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 80.205 24.823 9.186 1.00 0.00 H new ATOM 1243 N TRP A 77 73.802 26.144 4.653 1.00 0.00 N ATOM 1244 CA TRP A 77 72.583 26.944 4.624 1.00 0.00 C ATOM 1245 C TRP A 77 71.451 26.238 5.363 1.00 0.00 C ATOM 1246 O TRP A 77 70.779 26.834 6.205 1.00 0.00 O ATOM 1247 CB TRP A 77 72.168 27.227 3.180 1.00 0.00 C ATOM 1248 CG TRP A 77 70.803 27.834 3.062 1.00 0.00 C ATOM 1249 CD1 TRP A 77 70.435 29.100 3.419 1.00 0.00 C ATOM 1250 CD2 TRP A 77 69.624 27.200 2.554 1.00 0.00 C ATOM 1251 NE1 TRP A 77 69.098 29.291 3.164 1.00 0.00 N ATOM 1252 CE2 TRP A 77 68.578 28.141 2.632 1.00 0.00 C ATOM 1253 CE3 TRP A 77 69.350 25.930 2.039 1.00 0.00 C ATOM 1254 CZ2 TRP A 77 67.282 27.849 2.216 1.00 0.00 C ATOM 1255 CZ3 TRP A 77 68.063 25.642 1.626 1.00 0.00 C ATOM 1256 CH2 TRP A 77 67.042 26.598 1.715 1.00 0.00 C ATOM 0 H TRP A 77 74.104 25.803 3.741 1.00 0.00 H new ATOM 0 HA TRP A 77 72.786 27.889 5.127 1.00 0.00 H new ATOM 0 HB2 TRP A 77 72.897 27.898 2.725 1.00 0.00 H new ATOM 0 HB3 TRP A 77 72.194 26.296 2.613 1.00 0.00 H new ATOM 0 HD1 TRP A 77 71.097 29.842 3.840 1.00 0.00 H new ATOM 0 HE1 TRP A 77 68.577 30.150 3.342 1.00 0.00 H new ATOM 0 HE3 TRP A 77 70.130 25.187 1.965 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 66.494 28.584 2.286 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 67.840 24.663 1.228 1.00 0.00 H new ATOM 0 HH2 TRP A 77 66.047 26.343 1.382 1.00 0.00 H new ATOM 1267 N LYS A 78 71.245 24.965 5.043 1.00 0.00 N ATOM 1268 CA LYS A 78 70.195 24.176 5.676 1.00 0.00 C ATOM 1269 C LYS A 78 70.387 24.131 7.189 1.00 0.00 C ATOM 1270 O LYS A 78 69.433 24.290 7.952 1.00 0.00 O ATOM 1271 CB LYS A 78 70.185 22.755 5.110 1.00 0.00 C ATOM 1272 CG LYS A 78 69.226 21.821 5.828 1.00 0.00 C ATOM 1273 CD LYS A 78 68.682 20.754 4.893 1.00 0.00 C ATOM 1274 CE LYS A 78 69.609 19.550 4.823 1.00 0.00 C ATOM 1275 NZ LYS A 78 69.014 18.438 4.030 1.00 0.00 N ATOM 0 H LYS A 78 71.792 24.457 4.348 1.00 0.00 H new ATOM 0 HA LYS A 78 69.238 24.652 5.462 1.00 0.00 H new ATOM 0 HB2 LYS A 78 69.917 22.795 4.054 1.00 0.00 H new ATOM 0 HB3 LYS A 78 71.192 22.343 5.168 1.00 0.00 H new ATOM 0 HG2 LYS A 78 69.738 21.346 6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 78 68.400 22.397 6.245 1.00 0.00 H new ATOM 0 HD2 LYS A 78 67.697 20.437 5.235 1.00 0.00 H new ATOM 0 HD3 LYS A 78 68.553 21.174 3.895 1.00 0.00 H new ATOM 0 HE2 LYS A 78 70.558 19.847 4.376 1.00 0.00 H new ATOM 0 HE3 LYS A 78 69.827 19.200 5.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 69.676 17.636 4.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 68.121 18.137 4.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 68.829 18.764 3.060 1.00 0.00 H new ATOM 1289 N THR A 79 71.627 23.914 7.618 1.00 0.00 N ATOM 1290 CA THR A 79 71.943 23.849 9.039 1.00 0.00 C ATOM 1291 C THR A 79 71.698 25.191 9.719 1.00 0.00 C ATOM 1292 O THR A 79 71.005 25.266 10.735 1.00 0.00 O ATOM 1293 CB THR A 79 73.407 23.429 9.270 1.00 0.00 C ATOM 1294 OG1 THR A 79 73.713 22.267 8.490 1.00 0.00 O ATOM 1295 CG2 THR A 79 73.662 23.140 10.741 1.00 0.00 C ATOM 0 H THR A 79 72.428 23.780 7.001 1.00 0.00 H new ATOM 0 HA THR A 79 71.284 23.098 9.475 1.00 0.00 H new ATOM 0 HB THR A 79 74.051 24.253 8.961 1.00 0.00 H new ATOM 0 HG1 THR A 79 73.839 22.526 7.553 1.00 0.00 H new ATOM 0 HG21 THR A 79 74.702 22.845 10.879 1.00 0.00 H new ATOM 0 HG22 THR A 79 73.457 24.035 11.328 1.00 0.00 H new ATOM 0 HG23 THR A 79 73.009 22.332 11.072 1.00 0.00 H new ATOM 1303 N LEU A 80 72.269 26.248 9.154 1.00 0.00 N ATOM 1304 CA LEU A 80 72.112 27.590 9.706 1.00 0.00 C ATOM 1305 C LEU A 80 70.640 27.985 9.763 1.00 0.00 C ATOM 1306 O LEU A 80 70.221 28.732 10.648 1.00 0.00 O ATOM 1307 CB LEU A 80 72.892 28.603 8.867 1.00 0.00 C ATOM 1308 CG LEU A 80 72.068 29.436 7.884 1.00 0.00 C ATOM 1309 CD1 LEU A 80 71.444 30.630 8.588 1.00 0.00 C ATOM 1310 CD2 LEU A 80 72.933 29.893 6.718 1.00 0.00 C ATOM 0 H LEU A 80 72.845 26.203 8.314 1.00 0.00 H new ATOM 0 HA LEU A 80 72.509 27.588 10.721 1.00 0.00 H new ATOM 0 HB2 LEU A 80 73.410 29.283 9.543 1.00 0.00 H new ATOM 0 HB3 LEU A 80 73.658 28.067 8.306 1.00 0.00 H new ATOM 0 HG LEU A 80 71.265 28.812 7.492 1.00 0.00 H new ATOM 0 HD11 LEU A 80 70.862 31.211 7.873 1.00 0.00 H new ATOM 0 HD12 LEU A 80 70.792 30.280 9.388 1.00 0.00 H new ATOM 0 HD13 LEU A 80 72.231 31.256 9.009 1.00 0.00 H new ATOM 0 HD21 LEU A 80 72.331 30.484 6.028 1.00 0.00 H new ATOM 0 HD22 LEU A 80 73.757 30.500 7.092 1.00 0.00 H new ATOM 0 HD23 LEU A 80 73.331 29.022 6.197 1.00 0.00 H new ATOM 1322 N VAL A 81 69.858 27.478 8.815 1.00 0.00 N ATOM 1323 CA VAL A 81 68.432 27.776 8.759 1.00 0.00 C ATOM 1324 C VAL A 81 67.693 27.144 9.933 1.00 0.00 C ATOM 1325 O VAL A 81 66.852 27.782 10.567 1.00 0.00 O ATOM 1326 CB VAL A 81 67.806 27.277 7.444 1.00 0.00 C ATOM 1327 CG1 VAL A 81 66.290 27.220 7.561 1.00 0.00 C ATOM 1328 CG2 VAL A 81 68.226 28.167 6.283 1.00 0.00 C ATOM 0 H VAL A 81 70.188 26.859 8.075 1.00 0.00 H new ATOM 0 HA VAL A 81 68.332 28.860 8.811 1.00 0.00 H new ATOM 0 HB VAL A 81 68.169 26.268 7.249 1.00 0.00 H new ATOM 0 HG11 VAL A 81 65.866 26.865 6.622 1.00 0.00 H new ATOM 0 HG12 VAL A 81 66.013 26.538 8.365 1.00 0.00 H new ATOM 0 HG13 VAL A 81 65.904 28.216 7.780 1.00 0.00 H new ATOM 0 HG21 VAL A 81 67.775 27.800 5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 81 67.893 29.188 6.468 1.00 0.00 H new ATOM 0 HG23 VAL A 81 69.312 28.151 6.187 1.00 0.00 H new ATOM 1338 N HIS A 82 68.011 25.885 10.218 1.00 0.00 N ATOM 1339 CA HIS A 82 67.378 25.166 11.317 1.00 0.00 C ATOM 1340 C HIS A 82 67.707 25.821 12.656 1.00 0.00 C ATOM 1341 O HIS A 82 66.866 25.881 13.554 1.00 0.00 O ATOM 1342 CB HIS A 82 67.829 23.705 11.326 1.00 0.00 C ATOM 1343 CG HIS A 82 67.059 22.847 12.282 1.00 0.00 C ATOM 1344 ND1 HIS A 82 65.709 22.599 12.151 1.00 0.00 N ATOM 1345 CD2 HIS A 82 67.458 22.175 13.387 1.00 0.00 C ATOM 1346 CE1 HIS A 82 65.310 21.813 13.135 1.00 0.00 C ATOM 1347 NE2 HIS A 82 66.352 21.541 13.899 1.00 0.00 N ATOM 0 H HIS A 82 68.704 25.342 9.703 1.00 0.00 H new ATOM 0 HA HIS A 82 66.299 25.204 11.169 1.00 0.00 H new ATOM 0 HB2 HIS A 82 67.728 23.296 10.321 1.00 0.00 H new ATOM 0 HB3 HIS A 82 68.887 23.661 11.583 1.00 0.00 H new ATOM 0 HD2 HIS A 82 68.459 22.143 13.791 1.00 0.00 H new ATOM 0 HE1 HIS A 82 64.303 21.454 13.288 1.00 0.00 H new ATOM 0 HE2 HIS A 82 66.338 20.955 14.734 1.00 0.00 H new ATOM 1355 N THR A 83 68.936 26.310 12.784 1.00 0.00 N ATOM 1356 CA THR A 83 69.377 26.959 14.012 1.00 0.00 C ATOM 1357 C THR A 83 68.767 28.349 14.150 1.00 0.00 C ATOM 1358 O THR A 83 68.574 28.845 15.259 1.00 0.00 O ATOM 1359 CB THR A 83 70.912 27.077 14.066 1.00 0.00 C ATOM 1360 OG1 THR A 83 71.506 25.775 14.005 1.00 0.00 O ATOM 1361 CG2 THR A 83 71.356 27.784 15.337 1.00 0.00 C ATOM 0 H THR A 83 69.644 26.269 12.051 1.00 0.00 H new ATOM 0 HA THR A 83 69.039 26.333 14.838 1.00 0.00 H new ATOM 0 HB THR A 83 71.240 27.666 13.209 1.00 0.00 H new ATOM 0 HG1 THR A 83 72.482 25.859 14.038 1.00 0.00 H new ATOM 0 HG21 THR A 83 72.444 27.855 15.353 1.00 0.00 H new ATOM 0 HG22 THR A 83 70.926 28.785 15.366 1.00 0.00 H new ATOM 0 HG23 THR A 83 71.017 27.219 16.205 1.00 0.00 H new ATOM 1369 N ALA A 84 68.464 28.972 13.016 1.00 0.00 N ATOM 1370 CA ALA A 84 67.873 30.304 13.011 1.00 0.00 C ATOM 1371 C ALA A 84 66.354 30.231 12.894 1.00 0.00 C ATOM 1372 O ALA A 84 65.671 31.255 12.900 1.00 0.00 O ATOM 1373 CB ALA A 84 68.452 31.134 11.874 1.00 0.00 C ATOM 0 H ALA A 84 68.618 28.575 12.089 1.00 0.00 H new ATOM 0 HA ALA A 84 68.116 30.785 13.958 1.00 0.00 H new ATOM 0 HB1 ALA A 84 68.002 32.127 11.882 1.00 0.00 H new ATOM 0 HB2 ALA A 84 69.531 31.224 12.002 1.00 0.00 H new ATOM 0 HB3 ALA A 84 68.239 30.647 10.923 1.00 0.00 H new ATOM 1379 N SER A 85 65.832 29.013 12.788 1.00 0.00 N ATOM 1380 CA SER A 85 64.394 28.806 12.665 1.00 0.00 C ATOM 1381 C SER A 85 63.850 28.040 13.868 1.00 0.00 C ATOM 1382 O SER A 85 62.663 28.122 14.184 1.00 0.00 O ATOM 1383 CB SER A 85 64.074 28.047 11.376 1.00 0.00 C ATOM 1384 OG SER A 85 64.380 26.669 11.506 1.00 0.00 O ATOM 0 H SER A 85 66.383 28.155 12.785 1.00 0.00 H new ATOM 0 HA SER A 85 63.913 29.784 12.631 1.00 0.00 H new ATOM 0 HB2 SER A 85 63.018 28.167 11.132 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.642 28.473 10.549 1.00 0.00 H new ATOM 0 HG SER A 85 64.165 26.206 10.669 1.00 0.00 H new ATOM 1390 N ILE A 86 64.728 27.296 14.533 1.00 0.00 N ATOM 1391 CA ILE A 86 64.337 26.516 15.701 1.00 0.00 C ATOM 1392 C ILE A 86 63.354 27.289 16.574 1.00 0.00 C ATOM 1393 O ILE A 86 62.145 27.071 16.507 1.00 0.00 O ATOM 1394 CB ILE A 86 65.561 26.123 16.549 1.00 0.00 C ATOM 1395 CG1 ILE A 86 66.674 27.160 16.391 1.00 0.00 C ATOM 1396 CG2 ILE A 86 66.058 24.740 16.153 1.00 0.00 C ATOM 1397 CD1 ILE A 86 67.539 27.312 17.623 1.00 0.00 C ATOM 0 H ILE A 86 65.714 27.217 14.283 1.00 0.00 H new ATOM 0 HA ILE A 86 63.856 25.611 15.331 1.00 0.00 H new ATOM 0 HB ILE A 86 65.263 26.095 17.597 1.00 0.00 H new ATOM 0 HG12 ILE A 86 67.304 26.879 15.547 1.00 0.00 H new ATOM 0 HG13 ILE A 86 66.229 28.125 16.149 1.00 0.00 H new ATOM 0 HG21 ILE A 86 66.923 24.476 16.761 1.00 0.00 H new ATOM 0 HG22 ILE A 86 65.266 24.009 16.313 1.00 0.00 H new ATOM 0 HG23 ILE A 86 66.342 24.743 15.101 1.00 0.00 H new ATOM 0 HD11 ILE A 86 68.306 28.064 17.438 1.00 0.00 H new ATOM 0 HD12 ILE A 86 66.921 27.624 18.465 1.00 0.00 H new ATOM 0 HD13 ILE A 86 68.013 26.358 17.854 1.00 0.00 H new ATOM 1409 N ALA A 87 63.882 28.193 17.392 1.00 0.00 N ATOM 1410 CA ALA A 87 63.052 29.001 18.276 1.00 0.00 C ATOM 1411 C ALA A 87 63.808 30.230 18.769 1.00 0.00 C ATOM 1412 O ALA A 87 65.037 30.287 18.735 1.00 0.00 O ATOM 1413 CB ALA A 87 62.570 28.168 19.455 1.00 0.00 C ATOM 0 H ALA A 87 64.882 28.384 17.461 1.00 0.00 H new ATOM 0 HA ALA A 87 62.187 29.343 17.708 1.00 0.00 H new ATOM 0 HB1 ALA A 87 61.951 28.784 20.107 1.00 0.00 H new ATOM 0 HB2 ALA A 87 61.984 27.325 19.089 1.00 0.00 H new ATOM 0 HB3 ALA A 87 63.429 27.797 20.014 1.00 0.00 H new ATOM 1419 N PRO A 88 63.058 31.239 19.236 1.00 0.00 N ATOM 1420 CA PRO A 88 63.636 32.486 19.744 1.00 0.00 C ATOM 1421 C PRO A 88 64.370 32.289 21.067 1.00 0.00 C ATOM 1422 O PRO A 88 65.428 32.874 21.292 1.00 0.00 O ATOM 1423 CB PRO A 88 62.417 33.390 19.939 1.00 0.00 C ATOM 1424 CG PRO A 88 61.278 32.451 20.141 1.00 0.00 C ATOM 1425 CD PRO A 88 61.587 31.240 19.305 1.00 0.00 C ATOM 0 HA PRO A 88 64.382 32.895 19.063 1.00 0.00 H new ATOM 0 HB2 PRO A 88 62.545 34.048 20.799 1.00 0.00 H new ATOM 0 HB3 PRO A 88 62.255 34.029 19.071 1.00 0.00 H new ATOM 0 HG2 PRO A 88 61.175 32.183 21.193 1.00 0.00 H new ATOM 0 HG3 PRO A 88 60.337 32.907 19.834 1.00 0.00 H new ATOM 0 HD2 PRO A 88 61.206 30.327 19.763 1.00 0.00 H new ATOM 0 HD3 PRO A 88 61.138 31.311 18.314 1.00 0.00 H new ATOM 1433 N GLN A 89 63.799 31.461 21.936 1.00 0.00 N ATOM 1434 CA GLN A 89 64.400 31.187 23.236 1.00 0.00 C ATOM 1435 C GLN A 89 65.701 30.407 23.081 1.00 0.00 C ATOM 1436 O GLN A 89 66.592 30.495 23.926 1.00 0.00 O ATOM 1437 CB GLN A 89 63.425 30.405 24.118 1.00 0.00 C ATOM 1438 CG GLN A 89 63.118 29.011 23.596 1.00 0.00 C ATOM 1439 CD GLN A 89 61.684 28.593 23.855 1.00 0.00 C ATOM 1440 OE1 GLN A 89 60.750 29.144 23.271 1.00 0.00 O ATOM 1441 NE2 GLN A 89 61.501 27.615 24.735 1.00 0.00 N ATOM 0 H GLN A 89 62.922 30.969 21.764 1.00 0.00 H new ATOM 0 HA GLN A 89 64.624 32.141 23.712 1.00 0.00 H new ATOM 0 HB2 GLN A 89 63.841 30.325 25.122 1.00 0.00 H new ATOM 0 HB3 GLN A 89 62.494 30.966 24.202 1.00 0.00 H new ATOM 0 HG2 GLN A 89 63.314 28.977 22.524 1.00 0.00 H new ATOM 0 HG3 GLN A 89 63.792 28.295 24.066 1.00 0.00 H new ATOM 0 HE21 GLN A 89 62.304 27.187 25.196 1.00 0.00 H new ATOM 0 HE22 GLN A 89 60.558 27.292 24.950 1.00 0.00 H new ATOM 1450 N GLN A 90 65.803 29.645 21.997 1.00 0.00 N ATOM 1451 CA GLN A 90 66.996 28.849 21.733 1.00 0.00 C ATOM 1452 C GLN A 90 68.125 29.722 21.195 1.00 0.00 C ATOM 1453 O GLN A 90 69.080 30.029 21.910 1.00 0.00 O ATOM 1454 CB GLN A 90 66.679 27.733 20.736 1.00 0.00 C ATOM 1455 CG GLN A 90 65.654 26.734 21.246 1.00 0.00 C ATOM 1456 CD GLN A 90 66.145 25.960 22.454 1.00 0.00 C ATOM 1457 OE1 GLN A 90 66.055 26.434 23.587 1.00 0.00 O ATOM 1458 NE2 GLN A 90 66.667 24.762 22.219 1.00 0.00 N ATOM 0 H GLN A 90 65.075 29.562 21.288 1.00 0.00 H new ATOM 0 HA GLN A 90 67.322 28.405 22.674 1.00 0.00 H new ATOM 0 HB2 GLN A 90 66.312 28.177 19.811 1.00 0.00 H new ATOM 0 HB3 GLN A 90 67.600 27.203 20.492 1.00 0.00 H new ATOM 0 HG2 GLN A 90 64.736 27.261 21.506 1.00 0.00 H new ATOM 0 HG3 GLN A 90 65.405 26.035 20.448 1.00 0.00 H new ATOM 0 HE21 GLN A 90 66.722 24.408 21.264 1.00 0.00 H new ATOM 0 HE22 GLN A 90 67.013 24.196 22.994 1.00 0.00 H new ATOM 1467 N ARG A 91 68.010 30.119 19.932 1.00 0.00 N ATOM 1468 CA ARG A 91 69.022 30.955 19.299 1.00 0.00 C ATOM 1469 C ARG A 91 70.424 30.531 19.727 1.00 0.00 C ATOM 1470 O ARG A 91 71.282 31.371 19.997 1.00 0.00 O ATOM 1471 CB ARG A 91 68.793 32.426 19.651 1.00 0.00 C ATOM 1472 CG ARG A 91 68.938 32.726 21.134 1.00 0.00 C ATOM 1473 CD ARG A 91 69.153 34.211 21.383 1.00 0.00 C ATOM 1474 NE ARG A 91 69.755 34.465 22.689 1.00 0.00 N ATOM 1475 CZ ARG A 91 69.065 34.492 23.824 1.00 0.00 C ATOM 1476 NH1 ARG A 91 67.756 34.281 23.813 1.00 0.00 N ATOM 1477 NH2 ARG A 91 69.684 34.730 24.973 1.00 0.00 N ATOM 0 H ARG A 91 67.226 29.875 19.327 1.00 0.00 H new ATOM 0 HA ARG A 91 68.937 30.829 18.220 1.00 0.00 H new ATOM 0 HB2 ARG A 91 69.502 33.039 19.094 1.00 0.00 H new ATOM 0 HB3 ARG A 91 67.794 32.718 19.326 1.00 0.00 H new ATOM 0 HG2 ARG A 91 68.045 32.393 21.663 1.00 0.00 H new ATOM 0 HG3 ARG A 91 69.778 32.162 21.540 1.00 0.00 H new ATOM 0 HD2 ARG A 91 69.794 34.620 20.602 1.00 0.00 H new ATOM 0 HD3 ARG A 91 68.198 34.732 21.317 1.00 0.00 H new ATOM 0 HE ARG A 91 70.761 34.631 22.732 1.00 0.00 H new ATOM 0 HH11 ARG A 91 67.276 34.097 22.932 1.00 0.00 H new ATOM 0 HH12 ARG A 91 67.229 34.302 24.686 1.00 0.00 H new ATOM 0 HH21 ARG A 91 70.691 34.893 24.986 1.00 0.00 H new ATOM 0 HH22 ARG A 91 69.153 34.750 25.844 1.00 0.00 H new ATOM 1491 N ARG A 92 70.648 29.222 19.787 1.00 0.00 N ATOM 1492 CA ARG A 92 71.944 28.686 20.185 1.00 0.00 C ATOM 1493 C ARG A 92 72.891 28.612 18.990 1.00 0.00 C ATOM 1494 O ARG A 92 72.627 27.903 18.020 1.00 0.00 O ATOM 1495 CB ARG A 92 71.778 27.298 20.805 1.00 0.00 C ATOM 1496 CG ARG A 92 71.005 27.304 22.113 1.00 0.00 C ATOM 1497 CD ARG A 92 71.899 27.674 23.287 1.00 0.00 C ATOM 1498 NE ARG A 92 71.140 27.830 24.525 1.00 0.00 N ATOM 1499 CZ ARG A 92 71.688 27.781 25.734 1.00 0.00 C ATOM 1500 NH1 ARG A 92 72.992 27.580 25.866 1.00 0.00 N ATOM 1501 NH2 ARG A 92 70.932 27.932 26.813 1.00 0.00 N ATOM 0 H ARG A 92 69.949 28.513 19.565 1.00 0.00 H new ATOM 0 HA ARG A 92 72.375 29.358 20.928 1.00 0.00 H new ATOM 0 HB2 ARG A 92 71.266 26.650 20.093 1.00 0.00 H new ATOM 0 HB3 ARG A 92 72.764 26.866 20.977 1.00 0.00 H new ATOM 0 HG2 ARG A 92 70.179 28.012 22.046 1.00 0.00 H new ATOM 0 HG3 ARG A 92 70.568 26.320 22.283 1.00 0.00 H new ATOM 0 HD2 ARG A 92 72.658 26.903 23.422 1.00 0.00 H new ATOM 0 HD3 ARG A 92 72.424 28.603 23.064 1.00 0.00 H new ATOM 0 HE ARG A 92 70.134 27.985 24.458 1.00 0.00 H new ATOM 0 HH11 ARG A 92 73.576 27.463 25.038 1.00 0.00 H new ATOM 0 HH12 ARG A 92 73.411 27.543 26.795 1.00 0.00 H new ATOM 0 HH21 ARG A 92 69.928 28.086 26.715 1.00 0.00 H new ATOM 0 HH22 ARG A 92 71.354 27.894 27.741 1.00 0.00 H new ATOM 1515 N GLY A 93 73.994 29.349 19.068 1.00 0.00 N ATOM 1516 CA GLY A 93 74.963 29.353 17.988 1.00 0.00 C ATOM 1517 C GLY A 93 75.911 30.533 18.063 1.00 0.00 C ATOM 1518 O GLY A 93 75.721 31.440 18.872 1.00 0.00 O ATOM 0 H GLY A 93 74.234 29.944 19.861 1.00 0.00 H new ATOM 0 HA2 GLY A 93 75.538 28.427 18.016 1.00 0.00 H new ATOM 0 HA3 GLY A 93 74.438 29.373 17.033 1.00 0.00 H new ATOM 1522 N ALA A 94 76.937 30.521 17.218 1.00 0.00 N ATOM 1523 CA ALA A 94 77.918 31.598 17.191 1.00 0.00 C ATOM 1524 C ALA A 94 77.239 32.956 17.048 1.00 0.00 C ATOM 1525 O ALA A 94 76.087 33.059 16.626 1.00 0.00 O ATOM 1526 CB ALA A 94 78.911 31.380 16.059 1.00 0.00 C ATOM 0 H ALA A 94 77.110 29.776 16.543 1.00 0.00 H new ATOM 0 HA ALA A 94 78.457 31.589 18.138 1.00 0.00 H new ATOM 0 HB1 ALA A 94 79.638 32.192 16.051 1.00 0.00 H new ATOM 0 HB2 ALA A 94 79.428 30.432 16.206 1.00 0.00 H new ATOM 0 HB3 ALA A 94 78.379 31.360 15.108 1.00 0.00 H new ATOM 1532 N PRO A 95 77.967 34.023 17.407 1.00 0.00 N ATOM 1533 CA PRO A 95 77.454 35.394 17.327 1.00 0.00 C ATOM 1534 C PRO A 95 77.290 35.869 15.887 1.00 0.00 C ATOM 1535 O PRO A 95 78.245 36.325 15.260 1.00 0.00 O ATOM 1536 CB PRO A 95 78.529 36.217 18.042 1.00 0.00 C ATOM 1537 CG PRO A 95 79.777 35.415 17.900 1.00 0.00 C ATOM 1538 CD PRO A 95 79.347 33.974 17.918 1.00 0.00 C ATOM 0 HA PRO A 95 76.462 35.485 17.771 1.00 0.00 H new ATOM 0 HB2 PRO A 95 78.638 37.203 17.590 1.00 0.00 H new ATOM 0 HB3 PRO A 95 78.276 36.373 19.091 1.00 0.00 H new ATOM 0 HG2 PRO A 95 80.293 35.657 16.971 1.00 0.00 H new ATOM 0 HG3 PRO A 95 80.471 35.625 18.714 1.00 0.00 H new ATOM 0 HD2 PRO A 95 79.987 33.356 17.288 1.00 0.00 H new ATOM 0 HD3 PRO A 95 79.389 33.555 18.923 1.00 0.00 H new ATOM 1546 N VAL A 96 76.071 35.758 15.369 1.00 0.00 N ATOM 1547 CA VAL A 96 75.780 36.177 14.003 1.00 0.00 C ATOM 1548 C VAL A 96 74.705 37.257 13.976 1.00 0.00 C ATOM 1549 O VAL A 96 73.896 37.386 14.896 1.00 0.00 O ATOM 1550 CB VAL A 96 75.321 34.989 13.137 1.00 0.00 C ATOM 1551 CG1 VAL A 96 76.514 34.147 12.710 1.00 0.00 C ATOM 1552 CG2 VAL A 96 74.303 34.145 13.888 1.00 0.00 C ATOM 0 H VAL A 96 75.269 35.381 15.875 1.00 0.00 H new ATOM 0 HA VAL A 96 76.706 36.580 13.592 1.00 0.00 H new ATOM 0 HB VAL A 96 74.843 35.379 12.239 1.00 0.00 H new ATOM 0 HG11 VAL A 96 76.170 33.312 12.099 1.00 0.00 H new ATOM 0 HG12 VAL A 96 77.204 34.761 12.131 1.00 0.00 H new ATOM 0 HG13 VAL A 96 77.024 33.764 13.594 1.00 0.00 H new ATOM 0 HG21 VAL A 96 73.989 33.310 13.261 1.00 0.00 H new ATOM 0 HG22 VAL A 96 74.753 33.762 14.804 1.00 0.00 H new ATOM 0 HG23 VAL A 96 73.436 34.757 14.137 1.00 0.00 H new ATOM 1562 N PRO A 97 74.692 38.053 12.896 1.00 0.00 N ATOM 1563 CA PRO A 97 73.719 39.136 12.723 1.00 0.00 C ATOM 1564 C PRO A 97 72.308 38.614 12.476 1.00 0.00 C ATOM 1565 O PRO A 97 72.123 37.581 11.832 1.00 0.00 O ATOM 1566 CB PRO A 97 74.236 39.883 11.491 1.00 0.00 C ATOM 1567 CG PRO A 97 75.016 38.866 10.731 1.00 0.00 C ATOM 1568 CD PRO A 97 75.625 37.956 11.762 1.00 0.00 C ATOM 0 HA PRO A 97 73.639 39.759 13.614 1.00 0.00 H new ATOM 0 HB2 PRO A 97 73.414 40.279 10.894 1.00 0.00 H new ATOM 0 HB3 PRO A 97 74.861 40.730 11.775 1.00 0.00 H new ATOM 0 HG2 PRO A 97 74.372 38.309 10.050 1.00 0.00 H new ATOM 0 HG3 PRO A 97 75.788 39.340 10.124 1.00 0.00 H new ATOM 0 HD2 PRO A 97 75.708 36.933 11.396 1.00 0.00 H new ATOM 0 HD3 PRO A 97 76.629 38.278 12.039 1.00 0.00 H new ATOM 1576 N GLN A 98 71.317 39.334 12.992 1.00 0.00 N ATOM 1577 CA GLN A 98 69.922 38.942 12.827 1.00 0.00 C ATOM 1578 C GLN A 98 69.520 38.966 11.355 1.00 0.00 C ATOM 1579 O GLN A 98 68.743 38.127 10.901 1.00 0.00 O ATOM 1580 CB GLN A 98 69.011 39.869 13.632 1.00 0.00 C ATOM 1581 CG GLN A 98 69.115 41.330 13.223 1.00 0.00 C ATOM 1582 CD GLN A 98 68.386 42.256 14.176 1.00 0.00 C ATOM 1583 OE1 GLN A 98 69.009 42.980 14.954 1.00 0.00 O ATOM 1584 NE2 GLN A 98 67.060 42.238 14.122 1.00 0.00 N ATOM 0 H GLN A 98 71.454 40.191 13.527 1.00 0.00 H new ATOM 0 HA GLN A 98 69.811 37.923 13.198 1.00 0.00 H new ATOM 0 HB2 GLN A 98 67.978 39.540 13.516 1.00 0.00 H new ATOM 0 HB3 GLN A 98 69.257 39.778 14.690 1.00 0.00 H new ATOM 0 HG2 GLN A 98 70.166 41.616 13.177 1.00 0.00 H new ATOM 0 HG3 GLN A 98 68.707 41.452 12.220 1.00 0.00 H new ATOM 0 HE21 GLN A 98 66.585 41.622 13.462 1.00 0.00 H new ATOM 0 HE22 GLN A 98 66.516 42.840 14.741 1.00 0.00 H new ATOM 1593 N GLU A 99 70.055 39.933 10.617 1.00 0.00 N ATOM 1594 CA GLU A 99 69.751 40.067 9.197 1.00 0.00 C ATOM 1595 C GLU A 99 70.039 38.765 8.454 1.00 0.00 C ATOM 1596 O GLU A 99 69.357 38.425 7.487 1.00 0.00 O ATOM 1597 CB GLU A 99 70.564 41.208 8.583 1.00 0.00 C ATOM 1598 CG GLU A 99 72.054 41.115 8.868 1.00 0.00 C ATOM 1599 CD GLU A 99 72.885 41.937 7.901 1.00 0.00 C ATOM 1600 OE1 GLU A 99 72.731 41.747 6.677 1.00 0.00 O ATOM 1601 OE2 GLU A 99 73.688 42.770 8.370 1.00 0.00 O ATOM 0 H GLU A 99 70.701 40.635 10.978 1.00 0.00 H new ATOM 0 HA GLU A 99 68.689 40.294 9.099 1.00 0.00 H new ATOM 0 HB2 GLU A 99 70.409 41.214 7.504 1.00 0.00 H new ATOM 0 HB3 GLU A 99 70.188 42.157 8.965 1.00 0.00 H new ATOM 0 HG2 GLU A 99 72.247 41.453 9.886 1.00 0.00 H new ATOM 0 HG3 GLU A 99 72.366 40.072 8.814 1.00 0.00 H new ATOM 1608 N LEU A 100 71.054 38.041 8.913 1.00 0.00 N ATOM 1609 CA LEU A 100 71.434 36.777 8.293 1.00 0.00 C ATOM 1610 C LEU A 100 70.341 35.729 8.479 1.00 0.00 C ATOM 1611 O LEU A 100 70.056 34.945 7.572 1.00 0.00 O ATOM 1612 CB LEU A 100 72.749 36.270 8.887 1.00 0.00 C ATOM 1613 CG LEU A 100 73.999 36.490 8.035 1.00 0.00 C ATOM 1614 CD1 LEU A 100 74.067 37.930 7.550 1.00 0.00 C ATOM 1615 CD2 LEU A 100 75.251 36.131 8.823 1.00 0.00 C ATOM 0 H LEU A 100 71.628 38.308 9.712 1.00 0.00 H new ATOM 0 HA LEU A 100 71.568 36.950 7.225 1.00 0.00 H new ATOM 0 HB2 LEU A 100 72.900 36.756 9.851 1.00 0.00 H new ATOM 0 HB3 LEU A 100 72.649 35.202 9.081 1.00 0.00 H new ATOM 0 HG LEU A 100 73.942 35.837 7.164 1.00 0.00 H new ATOM 0 HD11 LEU A 100 74.963 38.068 6.945 1.00 0.00 H new ATOM 0 HD12 LEU A 100 73.186 38.154 6.949 1.00 0.00 H new ATOM 0 HD13 LEU A 100 74.101 38.602 8.408 1.00 0.00 H new ATOM 0 HD21 LEU A 100 76.131 36.294 8.201 1.00 0.00 H new ATOM 0 HD22 LEU A 100 75.314 36.758 9.712 1.00 0.00 H new ATOM 0 HD23 LEU A 100 75.206 35.083 9.121 1.00 0.00 H new ATOM 1627 N LEU A 101 69.730 35.722 9.658 1.00 0.00 N ATOM 1628 CA LEU A 101 68.666 34.772 9.963 1.00 0.00 C ATOM 1629 C LEU A 101 67.368 35.165 9.264 1.00 0.00 C ATOM 1630 O LEU A 101 66.523 34.316 8.979 1.00 0.00 O ATOM 1631 CB LEU A 101 68.441 34.695 11.474 1.00 0.00 C ATOM 1632 CG LEU A 101 69.633 34.219 12.306 1.00 0.00 C ATOM 1633 CD1 LEU A 101 70.623 33.461 11.436 1.00 0.00 C ATOM 1634 CD2 LEU A 101 70.312 35.397 12.989 1.00 0.00 C ATOM 0 H LEU A 101 69.953 36.364 10.419 1.00 0.00 H new ATOM 0 HA LEU A 101 68.972 33.792 9.597 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.147 35.683 11.828 1.00 0.00 H new ATOM 0 HB3 LEU A 101 67.601 34.026 11.663 1.00 0.00 H new ATOM 0 HG LEU A 101 69.266 33.541 13.077 1.00 0.00 H new ATOM 0 HD11 LEU A 101 71.464 33.130 12.045 1.00 0.00 H new ATOM 0 HD12 LEU A 101 70.131 32.594 10.996 1.00 0.00 H new ATOM 0 HD13 LEU A 101 70.985 34.115 10.642 1.00 0.00 H new ATOM 0 HD21 LEU A 101 71.158 35.039 13.576 1.00 0.00 H new ATOM 0 HD22 LEU A 101 70.666 36.100 12.235 1.00 0.00 H new ATOM 0 HD23 LEU A 101 69.600 35.897 13.646 1.00 0.00 H new ATOM 1646 N ASP A 102 67.218 36.456 8.989 1.00 0.00 N ATOM 1647 CA ASP A 102 66.025 36.962 8.320 1.00 0.00 C ATOM 1648 C ASP A 102 66.057 36.634 6.831 1.00 0.00 C ATOM 1649 O ASP A 102 65.027 36.330 6.230 1.00 0.00 O ATOM 1650 CB ASP A 102 65.904 38.473 8.521 1.00 0.00 C ATOM 1651 CG ASP A 102 64.772 39.076 7.711 1.00 0.00 C ATOM 1652 OD1 ASP A 102 64.982 39.350 6.511 1.00 0.00 O ATOM 1653 OD2 ASP A 102 63.677 39.273 8.278 1.00 0.00 O ATOM 0 H ASP A 102 67.908 37.171 9.219 1.00 0.00 H new ATOM 0 HA ASP A 102 65.156 36.475 8.762 1.00 0.00 H new ATOM 0 HB2 ASP A 102 65.743 38.684 9.578 1.00 0.00 H new ATOM 0 HB3 ASP A 102 66.843 38.950 8.240 1.00 0.00 H new ATOM 1658 N ARG A 103 67.246 36.700 6.241 1.00 0.00 N ATOM 1659 CA ARG A 103 67.412 36.413 4.822 1.00 0.00 C ATOM 1660 C ARG A 103 67.312 34.914 4.554 1.00 0.00 C ATOM 1661 O ARG A 103 66.669 34.486 3.596 1.00 0.00 O ATOM 1662 CB ARG A 103 68.760 36.941 4.327 1.00 0.00 C ATOM 1663 CG ARG A 103 69.949 36.402 5.106 1.00 0.00 C ATOM 1664 CD ARG A 103 71.258 36.990 4.603 1.00 0.00 C ATOM 1665 NE ARG A 103 71.372 36.909 3.150 1.00 0.00 N ATOM 1666 CZ ARG A 103 72.223 37.639 2.437 1.00 0.00 C ATOM 1667 NH1 ARG A 103 73.030 38.500 3.042 1.00 0.00 N ATOM 1668 NH2 ARG A 103 72.267 37.509 1.118 1.00 0.00 N ATOM 0 H ARG A 103 68.109 36.950 6.724 1.00 0.00 H new ATOM 0 HA ARG A 103 66.611 36.916 4.280 1.00 0.00 H new ATOM 0 HB2 ARG A 103 68.878 36.682 3.275 1.00 0.00 H new ATOM 0 HB3 ARG A 103 68.759 38.029 4.389 1.00 0.00 H new ATOM 0 HG2 ARG A 103 69.827 36.634 6.164 1.00 0.00 H new ATOM 0 HG3 ARG A 103 69.980 35.316 5.019 1.00 0.00 H new ATOM 0 HD2 ARG A 103 71.331 38.032 4.915 1.00 0.00 H new ATOM 0 HD3 ARG A 103 72.093 36.461 5.062 1.00 0.00 H new ATOM 0 HE ARG A 103 70.765 36.256 2.655 1.00 0.00 H new ATOM 0 HH11 ARG A 103 72.998 38.603 4.056 1.00 0.00 H new ATOM 0 HH12 ARG A 103 73.683 39.060 2.493 1.00 0.00 H new ATOM 0 HH21 ARG A 103 71.647 36.848 0.650 1.00 0.00 H new ATOM 0 HH22 ARG A 103 72.921 38.070 0.572 1.00 0.00 H new ATOM 1682 N VAL A 104 67.952 34.122 5.408 1.00 0.00 N ATOM 1683 CA VAL A 104 67.935 32.671 5.265 1.00 0.00 C ATOM 1684 C VAL A 104 66.542 32.110 5.530 1.00 0.00 C ATOM 1685 O VAL A 104 66.091 31.191 4.844 1.00 0.00 O ATOM 1686 CB VAL A 104 68.937 32.001 6.224 1.00 0.00 C ATOM 1687 CG1 VAL A 104 70.347 32.506 5.961 1.00 0.00 C ATOM 1688 CG2 VAL A 104 68.535 32.245 7.670 1.00 0.00 C ATOM 0 H VAL A 104 68.489 34.461 6.206 1.00 0.00 H new ATOM 0 HA VAL A 104 68.224 32.450 4.237 1.00 0.00 H new ATOM 0 HB VAL A 104 68.923 30.926 6.044 1.00 0.00 H new ATOM 0 HG11 VAL A 104 71.041 32.022 6.648 1.00 0.00 H new ATOM 0 HG12 VAL A 104 70.631 32.274 4.935 1.00 0.00 H new ATOM 0 HG13 VAL A 104 70.381 33.585 6.112 1.00 0.00 H new ATOM 0 HG21 VAL A 104 69.254 31.765 8.334 1.00 0.00 H new ATOM 0 HG22 VAL A 104 68.519 33.317 7.867 1.00 0.00 H new ATOM 0 HG23 VAL A 104 67.543 31.829 7.847 1.00 0.00 H new ATOM 1698 N LEU A 105 65.865 32.667 6.527 1.00 0.00 N ATOM 1699 CA LEU A 105 64.522 32.223 6.882 1.00 0.00 C ATOM 1700 C LEU A 105 63.524 32.570 5.782 1.00 0.00 C ATOM 1701 O LEU A 105 62.785 31.709 5.306 1.00 0.00 O ATOM 1702 CB LEU A 105 64.085 32.860 8.202 1.00 0.00 C ATOM 1703 CG LEU A 105 64.615 32.199 9.475 1.00 0.00 C ATOM 1704 CD1 LEU A 105 64.292 33.050 10.693 1.00 0.00 C ATOM 1705 CD2 LEU A 105 64.036 30.801 9.631 1.00 0.00 C ATOM 0 H LEU A 105 66.224 33.427 7.104 1.00 0.00 H new ATOM 0 HA LEU A 105 64.544 31.139 6.998 1.00 0.00 H new ATOM 0 HB2 LEU A 105 64.400 33.903 8.200 1.00 0.00 H new ATOM 0 HB3 LEU A 105 62.996 32.856 8.241 1.00 0.00 H new ATOM 0 HG LEU A 105 65.699 32.115 9.393 1.00 0.00 H new ATOM 0 HD11 LEU A 105 64.677 32.563 11.589 1.00 0.00 H new ATOM 0 HD12 LEU A 105 64.755 34.031 10.585 1.00 0.00 H new ATOM 0 HD13 LEU A 105 63.212 33.167 10.779 1.00 0.00 H new ATOM 0 HD21 LEU A 105 64.424 30.346 10.542 1.00 0.00 H new ATOM 0 HD22 LEU A 105 62.949 30.862 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 105 64.319 30.192 8.772 1.00 0.00 H new ATOM 1717 N ALA A 106 63.510 33.837 5.381 1.00 0.00 N ATOM 1718 CA ALA A 106 62.607 34.298 4.334 1.00 0.00 C ATOM 1719 C ALA A 106 62.783 33.480 3.059 1.00 0.00 C ATOM 1720 O ALA A 106 61.809 33.001 2.478 1.00 0.00 O ATOM 1721 CB ALA A 106 62.836 35.775 4.051 1.00 0.00 C ATOM 0 H ALA A 106 64.114 34.563 5.766 1.00 0.00 H new ATOM 0 HA ALA A 106 61.584 34.161 4.685 1.00 0.00 H new ATOM 0 HB1 ALA A 106 62.155 36.105 3.267 1.00 0.00 H new ATOM 0 HB2 ALA A 106 62.653 36.352 4.958 1.00 0.00 H new ATOM 0 HB3 ALA A 106 63.865 35.928 3.725 1.00 0.00 H new ATOM 1727 N ALA A 107 64.031 33.324 2.629 1.00 0.00 N ATOM 1728 CA ALA A 107 64.333 32.563 1.423 1.00 0.00 C ATOM 1729 C ALA A 107 63.837 31.126 1.542 1.00 0.00 C ATOM 1730 O ALA A 107 63.265 30.577 0.601 1.00 0.00 O ATOM 1731 CB ALA A 107 65.829 32.586 1.146 1.00 0.00 C ATOM 0 H ALA A 107 64.849 33.714 3.098 1.00 0.00 H new ATOM 0 HA ALA A 107 63.812 33.031 0.588 1.00 0.00 H new ATOM 0 HB1 ALA A 107 66.041 32.014 0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 107 66.158 33.616 1.009 1.00 0.00 H new ATOM 0 HB3 ALA A 107 66.362 32.144 1.988 1.00 0.00 H new ATOM 1737 N GLN A 108 64.061 30.522 2.705 1.00 0.00 N ATOM 1738 CA GLN A 108 63.638 29.147 2.945 1.00 0.00 C ATOM 1739 C GLN A 108 62.141 28.988 2.699 1.00 0.00 C ATOM 1740 O GLN A 108 61.711 28.064 2.009 1.00 0.00 O ATOM 1741 CB GLN A 108 63.979 28.729 4.377 1.00 0.00 C ATOM 1742 CG GLN A 108 64.218 27.236 4.534 1.00 0.00 C ATOM 1743 CD GLN A 108 63.225 26.401 3.749 1.00 0.00 C ATOM 1744 OE1 GLN A 108 63.553 25.852 2.697 1.00 0.00 O ATOM 1745 NE2 GLN A 108 62.003 26.299 4.259 1.00 0.00 N ATOM 0 H GLN A 108 64.532 30.963 3.495 1.00 0.00 H new ATOM 0 HA GLN A 108 64.173 28.501 2.248 1.00 0.00 H new ATOM 0 HB2 GLN A 108 64.870 29.267 4.702 1.00 0.00 H new ATOM 0 HB3 GLN A 108 63.166 29.030 5.038 1.00 0.00 H new ATOM 0 HG2 GLN A 108 65.229 26.997 4.204 1.00 0.00 H new ATOM 0 HG3 GLN A 108 64.156 26.971 5.589 1.00 0.00 H new ATOM 0 HE21 GLN A 108 61.774 26.771 5.134 1.00 0.00 H new ATOM 0 HE22 GLN A 108 61.293 25.749 3.776 1.00 0.00 H new ATOM 1754 N ALA A 109 61.353 29.894 3.268 1.00 0.00 N ATOM 1755 CA ALA A 109 59.905 29.855 3.108 1.00 0.00 C ATOM 1756 C ALA A 109 59.500 30.199 1.679 1.00 0.00 C ATOM 1757 O ALA A 109 58.585 29.593 1.120 1.00 0.00 O ATOM 1758 CB ALA A 109 59.240 30.807 4.091 1.00 0.00 C ATOM 0 H ALA A 109 61.693 30.664 3.844 1.00 0.00 H new ATOM 0 HA ALA A 109 59.569 28.840 3.318 1.00 0.00 H new ATOM 0 HB1 ALA A 109 58.159 30.768 3.960 1.00 0.00 H new ATOM 0 HB2 ALA A 109 59.493 30.514 5.110 1.00 0.00 H new ATOM 0 HB3 ALA A 109 59.591 31.823 3.908 1.00 0.00 H new ATOM 1764 N TYR A 110 60.186 31.173 1.093 1.00 0.00 N ATOM 1765 CA TYR A 110 59.896 31.600 -0.270 1.00 0.00 C ATOM 1766 C TYR A 110 59.939 30.416 -1.232 1.00 0.00 C ATOM 1767 O TYR A 110 59.076 30.276 -2.099 1.00 0.00 O ATOM 1768 CB TYR A 110 60.894 32.670 -0.716 1.00 0.00 C ATOM 1769 CG TYR A 110 60.496 34.073 -0.318 1.00 0.00 C ATOM 1770 CD1 TYR A 110 59.226 34.562 -0.598 1.00 0.00 C ATOM 1771 CD2 TYR A 110 61.389 34.910 0.339 1.00 0.00 C ATOM 1772 CE1 TYR A 110 58.858 35.843 -0.237 1.00 0.00 C ATOM 1773 CE2 TYR A 110 61.030 36.192 0.705 1.00 0.00 C ATOM 1774 CZ TYR A 110 59.763 36.655 0.415 1.00 0.00 C ATOM 1775 OH TYR A 110 59.400 37.932 0.777 1.00 0.00 O ATOM 0 H TYR A 110 60.948 31.682 1.541 1.00 0.00 H new ATOM 0 HA TYR A 110 58.891 32.022 -0.285 1.00 0.00 H new ATOM 0 HB2 TYR A 110 61.871 32.444 -0.289 1.00 0.00 H new ATOM 0 HB3 TYR A 110 61.001 32.625 -1.800 1.00 0.00 H new ATOM 0 HD1 TYR A 110 58.514 33.929 -1.107 1.00 0.00 H new ATOM 0 HD2 TYR A 110 62.382 34.552 0.568 1.00 0.00 H new ATOM 0 HE1 TYR A 110 57.867 36.207 -0.464 1.00 0.00 H new ATOM 0 HE2 TYR A 110 61.737 36.829 1.216 1.00 0.00 H new ATOM 0 HH TYR A 110 60.152 38.370 1.228 1.00 0.00 H new ATOM 1785 N TRP A 111 60.948 29.568 -1.071 1.00 0.00 N ATOM 1786 CA TRP A 111 61.104 28.395 -1.924 1.00 0.00 C ATOM 1787 C TRP A 111 60.255 27.235 -1.415 1.00 0.00 C ATOM 1788 O TRP A 111 59.970 26.292 -2.153 1.00 0.00 O ATOM 1789 CB TRP A 111 62.574 27.978 -1.988 1.00 0.00 C ATOM 1790 CG TRP A 111 63.487 29.083 -2.425 1.00 0.00 C ATOM 1791 CD1 TRP A 111 64.622 29.506 -1.795 1.00 0.00 C ATOM 1792 CD2 TRP A 111 63.339 29.908 -3.587 1.00 0.00 C ATOM 1793 NE1 TRP A 111 65.189 30.544 -2.495 1.00 0.00 N ATOM 1794 CE2 TRP A 111 64.422 30.809 -3.598 1.00 0.00 C ATOM 1795 CE3 TRP A 111 62.399 29.971 -4.619 1.00 0.00 C ATOM 1796 CZ2 TRP A 111 64.588 31.760 -4.601 1.00 0.00 C ATOM 1797 CZ3 TRP A 111 62.565 30.917 -5.613 1.00 0.00 C ATOM 1798 CH2 TRP A 111 63.652 31.800 -5.599 1.00 0.00 C ATOM 0 H TRP A 111 61.670 29.670 -0.358 1.00 0.00 H new ATOM 0 HA TRP A 111 60.764 28.657 -2.926 1.00 0.00 H new ATOM 0 HB2 TRP A 111 62.887 27.625 -1.005 1.00 0.00 H new ATOM 0 HB3 TRP A 111 62.676 27.139 -2.676 1.00 0.00 H new ATOM 0 HD1 TRP A 111 65.016 29.087 -0.881 1.00 0.00 H new ATOM 0 HE1 TRP A 111 66.043 31.037 -2.235 1.00 0.00 H new ATOM 0 HE3 TRP A 111 61.558 29.293 -4.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 65.425 32.442 -4.592 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 61.844 30.976 -6.415 1.00 0.00 H new ATOM 0 HH2 TRP A 111 63.754 32.527 -6.391 1.00 0.00 H new ATOM 1809 N SER A 112 59.854 27.312 -0.150 1.00 0.00 N ATOM 1810 CA SER A 112 59.040 26.265 0.458 1.00 0.00 C ATOM 1811 C SER A 112 57.619 26.290 -0.098 1.00 0.00 C ATOM 1812 O SER A 112 56.951 27.324 -0.079 1.00 0.00 O ATOM 1813 CB SER A 112 59.008 26.434 1.978 1.00 0.00 C ATOM 1814 OG SER A 112 58.424 25.305 2.604 1.00 0.00 O ATOM 0 H SER A 112 60.079 28.087 0.473 1.00 0.00 H new ATOM 0 HA SER A 112 59.489 25.302 0.216 1.00 0.00 H new ATOM 0 HB2 SER A 112 60.021 26.578 2.353 1.00 0.00 H new ATOM 0 HB3 SER A 112 58.443 27.330 2.236 1.00 0.00 H new ATOM 0 HG SER A 112 57.550 25.551 2.973 1.00 0.00 H new ATOM 1820 N VAL A 113 57.164 25.143 -0.593 1.00 0.00 N ATOM 1821 CA VAL A 113 55.823 25.031 -1.153 1.00 0.00 C ATOM 1822 C VAL A 113 54.773 25.545 -0.174 1.00 0.00 C ATOM 1823 O VAL A 113 53.730 26.057 -0.579 1.00 0.00 O ATOM 1824 CB VAL A 113 55.491 23.574 -1.527 1.00 0.00 C ATOM 1825 CG1 VAL A 113 55.534 22.684 -0.295 1.00 0.00 C ATOM 1826 CG2 VAL A 113 54.131 23.496 -2.205 1.00 0.00 C ATOM 0 H VAL A 113 57.705 24.278 -0.617 1.00 0.00 H new ATOM 0 HA VAL A 113 55.805 25.643 -2.055 1.00 0.00 H new ATOM 0 HB VAL A 113 56.243 23.216 -2.230 1.00 0.00 H new ATOM 0 HG11 VAL A 113 55.297 21.659 -0.578 1.00 0.00 H new ATOM 0 HG12 VAL A 113 56.531 22.718 0.144 1.00 0.00 H new ATOM 0 HG13 VAL A 113 54.805 23.037 0.434 1.00 0.00 H new ATOM 0 HG21 VAL A 113 53.912 22.460 -2.463 1.00 0.00 H new ATOM 0 HG22 VAL A 113 53.364 23.871 -1.527 1.00 0.00 H new ATOM 0 HG23 VAL A 113 54.141 24.101 -3.112 1.00 0.00 H new ATOM 1836 N ASP A 114 55.058 25.405 1.116 1.00 0.00 N ATOM 1837 CA ASP A 114 54.139 25.857 2.155 1.00 0.00 C ATOM 1838 C ASP A 114 54.898 26.249 3.419 1.00 0.00 C ATOM 1839 O ASP A 114 55.815 25.548 3.847 1.00 0.00 O ATOM 1840 CB ASP A 114 53.120 24.762 2.476 1.00 0.00 C ATOM 1841 CG ASP A 114 51.940 25.285 3.271 1.00 0.00 C ATOM 1842 OD1 ASP A 114 51.496 26.419 2.997 1.00 0.00 O ATOM 1843 OD2 ASP A 114 51.460 24.559 4.167 1.00 0.00 O ATOM 0 H ASP A 114 55.917 24.982 1.467 1.00 0.00 H new ATOM 0 HA ASP A 114 53.612 26.735 1.782 1.00 0.00 H new ATOM 0 HB2 ASP A 114 52.761 24.320 1.547 1.00 0.00 H new ATOM 0 HB3 ASP A 114 53.610 23.967 3.039 1.00 0.00 H new ATOM 1848 N SER A 115 54.510 27.374 4.011 1.00 0.00 N ATOM 1849 CA SER A 115 55.157 27.863 5.223 1.00 0.00 C ATOM 1850 C SER A 115 54.207 28.745 6.028 1.00 0.00 C ATOM 1851 O SER A 115 53.290 29.353 5.477 1.00 0.00 O ATOM 1852 CB SER A 115 56.423 28.646 4.870 1.00 0.00 C ATOM 1853 OG SER A 115 56.192 29.527 3.785 1.00 0.00 O ATOM 0 H SER A 115 53.751 27.964 3.671 1.00 0.00 H new ATOM 0 HA SER A 115 55.429 27.002 5.833 1.00 0.00 H new ATOM 0 HB2 SER A 115 56.757 29.214 5.738 1.00 0.00 H new ATOM 0 HB3 SER A 115 57.224 27.952 4.615 1.00 0.00 H new ATOM 0 HG SER A 115 55.265 29.845 3.813 1.00 0.00 H new ATOM 1859 N SER A 116 54.435 28.809 7.336 1.00 0.00 N ATOM 1860 CA SER A 116 53.598 29.612 8.219 1.00 0.00 C ATOM 1861 C SER A 116 53.863 31.101 8.013 1.00 0.00 C ATOM 1862 O SER A 116 54.621 31.490 7.126 1.00 0.00 O ATOM 1863 CB SER A 116 53.851 29.235 9.680 1.00 0.00 C ATOM 1864 OG SER A 116 55.139 29.654 10.098 1.00 0.00 O ATOM 0 H SER A 116 55.192 28.314 7.807 1.00 0.00 H new ATOM 0 HA SER A 116 52.555 29.408 7.974 1.00 0.00 H new ATOM 0 HB2 SER A 116 53.092 29.694 10.314 1.00 0.00 H new ATOM 0 HB3 SER A 116 53.759 28.156 9.802 1.00 0.00 H new ATOM 0 HG SER A 116 55.276 29.403 11.035 1.00 0.00 H new ATOM 1870 N GLY A 117 53.231 31.928 8.840 1.00 0.00 N ATOM 1871 CA GLY A 117 53.411 33.364 8.733 1.00 0.00 C ATOM 1872 C GLY A 117 54.870 33.772 8.787 1.00 0.00 C ATOM 1873 O GLY A 117 55.724 32.993 9.211 1.00 0.00 O ATOM 0 H GLY A 117 52.598 31.629 9.582 1.00 0.00 H new ATOM 0 HA2 GLY A 117 52.974 33.713 7.797 1.00 0.00 H new ATOM 0 HA3 GLY A 117 52.869 33.856 9.541 1.00 0.00 H new ATOM 1877 N ARG A 118 55.158 34.995 8.354 1.00 0.00 N ATOM 1878 CA ARG A 118 56.524 35.503 8.352 1.00 0.00 C ATOM 1879 C ARG A 118 56.881 36.108 9.706 1.00 0.00 C ATOM 1880 O ARG A 118 56.007 36.344 10.541 1.00 0.00 O ATOM 1881 CB ARG A 118 56.700 36.551 7.251 1.00 0.00 C ATOM 1882 CG ARG A 118 58.143 36.735 6.811 1.00 0.00 C ATOM 1883 CD ARG A 118 58.236 37.566 5.541 1.00 0.00 C ATOM 1884 NE ARG A 118 57.493 36.964 4.437 1.00 0.00 N ATOM 1885 CZ ARG A 118 57.226 37.596 3.300 1.00 0.00 C ATOM 1886 NH1 ARG A 118 57.638 38.843 3.118 1.00 0.00 N ATOM 1887 NH2 ARG A 118 56.544 36.981 2.342 1.00 0.00 N ATOM 0 H ARG A 118 54.463 35.652 8.000 1.00 0.00 H new ATOM 0 HA ARG A 118 57.195 34.666 8.159 1.00 0.00 H new ATOM 0 HB2 ARG A 118 56.100 36.263 6.388 1.00 0.00 H new ATOM 0 HB3 ARG A 118 56.312 37.506 7.605 1.00 0.00 H new ATOM 0 HG2 ARG A 118 58.708 37.220 7.607 1.00 0.00 H new ATOM 0 HG3 ARG A 118 58.601 35.760 6.644 1.00 0.00 H new ATOM 0 HD2 ARG A 118 57.851 38.567 5.734 1.00 0.00 H new ATOM 0 HD3 ARG A 118 59.282 37.677 5.256 1.00 0.00 H new ATOM 0 HE ARG A 118 57.161 36.006 4.545 1.00 0.00 H new ATOM 0 HH11 ARG A 118 58.162 39.319 3.852 1.00 0.00 H new ATOM 0 HH12 ARG A 118 57.431 39.326 2.244 1.00 0.00 H new ATOM 0 HH21 ARG A 118 56.224 36.022 2.479 1.00 0.00 H new ATOM 0 HH22 ARG A 118 56.339 37.467 1.469 1.00 0.00 H new ATOM 1901 N ILE A 119 58.170 36.355 9.917 1.00 0.00 N ATOM 1902 CA ILE A 119 58.641 36.932 11.170 1.00 0.00 C ATOM 1903 C ILE A 119 58.044 38.317 11.396 1.00 0.00 C ATOM 1904 O ILE A 119 58.357 39.265 10.676 1.00 0.00 O ATOM 1905 CB ILE A 119 60.177 37.038 11.198 1.00 0.00 C ATOM 1906 CG1 ILE A 119 60.809 35.661 10.983 1.00 0.00 C ATOM 1907 CG2 ILE A 119 60.643 37.640 12.515 1.00 0.00 C ATOM 1908 CD1 ILE A 119 60.448 34.657 12.055 1.00 0.00 C ATOM 0 H ILE A 119 58.906 36.165 9.237 1.00 0.00 H new ATOM 0 HA ILE A 119 58.316 36.264 11.967 1.00 0.00 H new ATOM 0 HB ILE A 119 60.496 37.694 10.388 1.00 0.00 H new ATOM 0 HG12 ILE A 119 60.496 35.274 10.013 1.00 0.00 H new ATOM 0 HG13 ILE A 119 61.893 35.769 10.948 1.00 0.00 H new ATOM 0 HG21 ILE A 119 61.731 37.708 12.519 1.00 0.00 H new ATOM 0 HG22 ILE A 119 60.216 38.636 12.631 1.00 0.00 H new ATOM 0 HG23 ILE A 119 60.316 37.007 13.340 1.00 0.00 H new ATOM 0 HD11 ILE A 119 60.931 33.704 11.838 1.00 0.00 H new ATOM 0 HD12 ILE A 119 60.786 35.023 13.025 1.00 0.00 H new ATOM 0 HD13 ILE A 119 59.367 34.520 12.076 1.00 0.00 H new ATOM 1920 N VAL A 120 57.182 38.427 12.403 1.00 0.00 N ATOM 1921 CA VAL A 120 56.543 39.696 12.727 1.00 0.00 C ATOM 1922 C VAL A 120 57.119 40.291 14.006 1.00 0.00 C ATOM 1923 O VAL A 120 56.434 40.385 15.025 1.00 0.00 O ATOM 1924 CB VAL A 120 55.020 39.532 12.891 1.00 0.00 C ATOM 1925 CG1 VAL A 120 54.357 39.316 11.539 1.00 0.00 C ATOM 1926 CG2 VAL A 120 54.708 38.382 13.836 1.00 0.00 C ATOM 0 H VAL A 120 56.911 37.652 13.008 1.00 0.00 H new ATOM 0 HA VAL A 120 56.741 40.371 11.894 1.00 0.00 H new ATOM 0 HB VAL A 120 54.618 40.448 13.324 1.00 0.00 H new ATOM 0 HG11 VAL A 120 53.282 39.202 11.675 1.00 0.00 H new ATOM 0 HG12 VAL A 120 54.553 40.175 10.897 1.00 0.00 H new ATOM 0 HG13 VAL A 120 54.761 38.416 11.075 1.00 0.00 H new ATOM 0 HG21 VAL A 120 53.628 38.280 13.941 1.00 0.00 H new ATOM 0 HG22 VAL A 120 55.123 37.458 13.434 1.00 0.00 H new ATOM 0 HG23 VAL A 120 55.150 38.583 14.812 1.00 0.00 H new ATOM 1936 N THR A 121 58.385 40.694 13.947 1.00 0.00 N ATOM 1937 CA THR A 121 59.055 41.280 15.101 1.00 0.00 C ATOM 1938 C THR A 121 59.005 42.802 15.052 1.00 0.00 C ATOM 1939 O THR A 121 59.955 43.478 15.449 1.00 0.00 O ATOM 1940 CB THR A 121 60.526 40.828 15.186 1.00 0.00 C ATOM 1941 OG1 THR A 121 61.123 41.328 16.387 1.00 0.00 O ATOM 1942 CG2 THR A 121 61.313 41.319 13.980 1.00 0.00 C ATOM 0 H THR A 121 58.967 40.625 13.112 1.00 0.00 H new ATOM 0 HA THR A 121 58.523 40.931 15.986 1.00 0.00 H new ATOM 0 HB THR A 121 60.549 39.738 15.196 1.00 0.00 H new ATOM 0 HG1 THR A 121 60.973 42.294 16.449 1.00 0.00 H new ATOM 0 HG21 THR A 121 62.348 40.988 14.062 1.00 0.00 H new ATOM 0 HG22 THR A 121 60.873 40.913 13.069 1.00 0.00 H new ATOM 0 HG23 THR A 121 61.282 42.408 13.944 1.00 0.00 H new ATOM 1950 N LEU A 122 57.892 43.337 14.562 1.00 0.00 N ATOM 1951 CA LEU A 122 57.717 44.782 14.462 1.00 0.00 C ATOM 1952 C LEU A 122 57.002 45.331 15.692 1.00 0.00 C ATOM 1953 O LEU A 122 57.346 46.399 16.197 1.00 0.00 O ATOM 1954 CB LEU A 122 56.928 45.133 13.199 1.00 0.00 C ATOM 1955 CG LEU A 122 56.812 46.623 12.873 1.00 0.00 C ATOM 1956 CD1 LEU A 122 56.653 46.830 11.375 1.00 0.00 C ATOM 1957 CD2 LEU A 122 55.646 47.245 13.626 1.00 0.00 C ATOM 0 H LEU A 122 57.097 42.792 14.228 1.00 0.00 H new ATOM 0 HA LEU A 122 58.704 45.240 14.405 1.00 0.00 H new ATOM 0 HB2 LEU A 122 57.395 44.631 12.352 1.00 0.00 H new ATOM 0 HB3 LEU A 122 55.923 44.724 13.297 1.00 0.00 H new ATOM 0 HG LEU A 122 57.729 47.118 13.192 1.00 0.00 H new ATOM 0 HD11 LEU A 122 56.572 47.896 11.162 1.00 0.00 H new ATOM 0 HD12 LEU A 122 57.521 46.421 10.857 1.00 0.00 H new ATOM 0 HD13 LEU A 122 55.752 46.322 11.031 1.00 0.00 H new ATOM 0 HD21 LEU A 122 55.579 48.305 13.382 1.00 0.00 H new ATOM 0 HD22 LEU A 122 54.720 46.747 13.338 1.00 0.00 H new ATOM 0 HD23 LEU A 122 55.802 47.129 14.699 1.00 0.00 H new TER 1969 LEU A 122